* LIGAND DATABASE FILE (OPLS2005)
*
001     101   103    191    290     560
    1     0 S   NP   _N1_     1    29.15554    94.08290   -23.16499
    2     1 S   H    _HN1     2     1.02778   103.00115   -74.70947
    3     1 S   H    _H1_     3     1.02960    79.88907    31.94474
    4     1 S   H    _H2_     4     1.02835    31.25784  -177.88021
    5     1 S   CT   _CA1     5     1.50127   136.71443   140.98626
    6     5 S   HC   _HA1     6     1.09576   105.21590    80.55282
    7     5 S   CO3  _C1_     7     1.53777   112.42079   -39.61746
    8     7 S   O2Z  _O11     8     1.26358   115.00507   -42.97203
    9     7 S   O2Z  _O12     9     1.26241   114.92094   136.17858
   10     5 S   CT   _CB1    10     1.53088   107.41366  -161.55926
   11    10 S   HC   HB11    11     1.09826   109.27447   -50.89635
   12    10 S   HC   HB12    12     1.09818   110.42711    65.63062
   13    10 S   CT   _CG1    13     1.53016   112.71775  -172.01389
   14    13 S   HC   HG11    14     1.09593   110.45517   -64.72742
   15    13 S   HC   HG12    15     1.09655   109.96819    54.50959
   16    13 S   C    _CD1    16     1.51813   112.30424   174.80586
   17    16 S   O    _OE1    17     1.22721   123.25143    -1.57632
   18    16 S   N    _N2_    18     1.38661   111.67123   178.89412
   19    18 S   H    _HN2    19     1.01567   119.01373     2.05452
   20    18 S   CT1  _CA2    20     1.46105   123.32953   179.42939
   21    20 S   HC   _HA2    21     1.09694   109.06940     1.31997
   22    20 S   C    _C2_    22     1.53437   108.95613  -113.55722
   23    22 S   O    _O2_    23     1.23028   122.31767  -143.66970
   24    20 S   CT   _CB2    32     1.53351   111.54773   122.92832
   25    24 S   HC   HB21    33     1.09544   110.96254    50.73922
   26    24 S   HC   HB22    34     1.09359   109.83648   169.71836
   27    22 S   N    _N3_    24     1.38502   113.38453    44.10413
   28    27 S   H    _HN3    25     1.01483   119.01720    -0.43835
   29    24 S   S    _SG2    35     1.82829   110.70736   -69.95962
   30    27 S   CT   _CA3    26     1.45435   123.39392   174.33047
   31    30 S   HC   HA31    27     1.09527   109.12375    26.27362
   32    30 S   HC   HA32    28     1.09486   107.13734   143.33138
   33    29 S   CT   _C25    36     1.83945    99.91990  -152.17895
   34    33 S   HC   _H8_    37     1.09380   107.69031    35.83941
   35    30 S   CO3  _C3_    29     1.52950   113.27659   -97.06429
   36    35 S   O2Z  _O31    30     1.26384   115.56448   -40.19680
   37    35 S   O2Z  _O32    31     1.26376   114.86885   140.59404
   38    33 S   CM   _C23    38     1.53392   108.78541   154.46937
   39    33 S   CT   _C26    98     1.52950   110.22247   -79.40093
   40    39 S   HC   _H27    99     1.09563   112.55455   -56.70918
   41    39 S   HC   _H28   100     1.09598   110.48093  -177.24693
   42    39 S   HC   _H29   101     1.09584   111.02380    64.05693
   43    38 S   CMA  _C22    39     1.36909   122.80439   -99.51138
   44    43 S   OM   _O38    40     1.26792   125.67538  -176.21224
   45    38 S   CT   _C24    94     1.51934   115.27125    80.87010
   46    45 S   HC   _H24    95     1.09472   110.72594   -50.36820
   47    45 S   HC   _H25    96     1.09425   113.42164  -169.85828
   48    45 S   HC   _H26    97     1.09476   110.27586    69.80892
   49    43 S   OS   _O37    41     1.40694   112.34891     0.24066
   50    49 S   CT   _C19    42     1.42979   119.30173   116.25373
   51    50 S   CO4  _C20    43     1.53099   118.87069   -40.14201
   52    51 S   O    _O35    44     1.22152   126.93763    52.68270
   53    50 S   CT   _C21    90     1.53316   109.38655    86.30896
   54    53 S   HC   _H21    91     1.09483   111.36086    41.63568
   55    53 S   HC   _H22    92     1.09545   111.07891   -76.88192
   56    53 S   HC   _H23    93     1.09160   112.90941   163.94750
   57    51 S   OS   _O36    45     1.36816   110.38710  -129.00443
   58    57 S   CT   _C17    46     1.44277   112.16116    -2.77848
   59    58 S   HC   _H6_    47     1.09573   106.49940   134.49097
   60    58 S   CT   _C16    48     1.53070   108.84913  -107.34258
   61    60 S   HC   _H5_    49     1.09848   108.47872    43.72371
   62    50 S   CT   _C18    64     1.54728   105.35873  -150.96068
   63    62 S   HC   _H7_    65     1.10149   104.79773    39.83324
   64    60 S   CM   _C15    50     1.51796   114.74974   -72.84594
   65    64 S   CM   _C14    51     1.33866   111.20472  -146.66650
   66    65 S   HC   _H20    52     1.08084   124.80365  -177.21006
   67    64 S   CT   _C27    86     1.48880   123.50402    36.82978
   68    67 S   HC   _H30    87     1.09425   110.79540   -64.83690
   69    67 S   HC   _H31    88     1.09521   111.51800   175.49068
   70    67 S   HC   _H32    89     1.09429   110.48141    55.88186
   71    65 S   CT   _C13    53     1.48996   111.74425     1.25070
   72    71 S   HC   _H18    54     1.09300   111.77221   138.90707
   73    71 S   HC   _H19    55     1.09616   109.46995  -101.45128
   74    60 S   CT   _C12    56     1.55084   117.49884   167.46132
   75    74 S   HC   _H4_    57     1.09885   108.83017   -94.19006
   76    74 S   CT   _C11    58     1.56212   118.33825    28.12161
   77    76 S   CT   _C10    59     1.55091   115.70574   -61.09256
   78    77 S   HC   _H16    60     1.09913   109.61243  -130.59347
   79    77 S   HC   _H17    61     1.09935   110.28911   115.35400
   80    76 S   CT   _C28    80     1.53802   114.45397    66.99597
   81    80 S   HC   _H33    81     1.09443   112.05021    60.59827
   82    80 S   HC   _H34    82     1.09237   112.10643   -62.13305
   83    80 S   HC   _H35    83     1.09710   110.52859   177.70578
   84    76 S   OH   _O39    84     1.44618   104.86958  -177.12376
   85    84 S   HO   _H36    85     0.97275   108.16685  -173.22772
   86    77 S   CT   _C9_    62     1.53066   116.13775    -7.60906
   87    86 S   HC   _H3_    63     1.09230   110.48714   -46.39661
   88    86 S   OS   _O34    66     1.45157   107.00642  -165.83141
   89    88 S   CO4  _C8_    67     1.35550   118.47888   108.59756
   90    89 S   O    _O33    68     1.22046   127.73564    -3.36622
   91    89 S   CM   _C6_    69     1.48092   107.91429   176.20682
   92    91 S   CM   _C5_    70     1.34389   119.94043  -120.02229
   93    92 S   HC   _H12    71     1.08881   117.96136  -178.94279
   94    91 S   CT   _C7_    76     1.49728   116.64697    60.77942
   95    94 S   HC   _H13    77     1.09484   110.69554   -67.07158
   96    94 S   HC   _H14    78     1.09503   110.37759    53.03717
   97    94 S   HC   _H15    79     1.09513   111.90862   172.78798
   98    92 S   CT   _C4_    72     1.49610   127.79145     2.79484
   99    98 S   HC   _H9_    73     1.09417   109.81259  -114.96219
  100    98 S   HC   _H10    74     1.09477   109.43793   126.50118
  101    98 S   HC   _H11    75     1.09235   113.56765     6.53639
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  13   7   2   1   1  12   5   2   1   1  10   3   4   2   1   1
  12  16  12   4   8   3   2   1   9  16   7  20   8  11   4  12
  11   5   5   2   1   1   8   4   3  12   4  12  12   6   5   6
   3   2   1   2   1   5   2   5   9   3  10   9   5   4   2   1
   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    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    43    45    39    40    41    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    43    44    49    45    46    47    48    39    40    41    42  
   38    43    45    39    40    41    42  
   36    37  
   37  
    0  
   43    44    49    50    45    46    47    48    39    40    41    42  
   40    41    42    43    45  
   41    42  
   42  
    0  
   44    49    50    51    62    53    45    46    47    48  
   49    50    45  
   46    47    48    49  
   47    48  
   48  
    0  
   50    51    52    57    58    86    62    63    53    54    55    56  
   51    52    57    58    59    60    77    86    87    62    63    88    53    54    55    56  
   52    57    58    59    60    86    62    63    53    54    55    56  
   57    58    62    53  
   54    55    56    57    58    62    63    86  
   55    56    62  
   56    62  
   62  
   58    59    60    61    64    74    86    62    63  
   59    60    61    64    65    71    74    75    76    77    86    87    62    63    88    67  
   60    61    64    74    86    62    63  
   61    64    65    66    71    72    73    74    75    76    77    86    62    63    80    84    67    68    69    70  
   64    65    71    74    75    76    62    67  
   63    88    89    64    74    76    77    78    79    86    87  
   88    77    86    87  
   65    66    71    72    73    74    75    76    67    68    69    70  
   66    71    72    73    74    75    76    67    68    69    70  
   71    72    73    74    67  
   68    69    70    71    74  
   69    70  
   70  
    0  
   72    73    74    75    76    77    80    84  
   73    74    75    76  
   74    75    76  
   75    76    77    78    79    86    80    81    82    83    84    85  
   76    77    80    84  
   77    78    79    86    87    88    80    81    82    83    84    85  
   78    79    86    87    88    89    80    81    82    83    84    85  
   79    86    87    88    80    84  
   86    87    88    80    84  
   81    82    83    84    85    86  
   82    83    84  
   83    84  
   84  
   85    86  
    0  
   87    88    89    90    91  
   88    89  
   89    90    91    92    94  
   90    91    92    93    98    94    95    96    97  
   91    92    94  
   92    93    98    99   100   101    94    95    96    97  
   93    98    99   100   101    94    95    96    97  
   98    99   100   101    94  
   95    96    97    98  
   96    97  
   97  
    0  
   99   100   101  
  100   101  
  101  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   58   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   65   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   77   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   85   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   86   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   88   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   89   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   91   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   92   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    43   465.000  1.376
   38    45   317.000  1.510
   43    44   745.000  1.250
   43    49   440.000  1.360
   49    50   320.000  1.410
   50    51   317.000  1.522
   50    62   268.000  1.529
   50    53   268.000  1.529
   51    52   570.000  1.229
   51    57   214.000  1.327
   57    58   320.000  1.410
   58    59   340.000  1.090
   58    60   268.000  1.529
   58    62   268.000  1.529
   60    61   340.000  1.090
   60    64   317.000  1.510
   60    74   268.000  1.529
   64    65   549.000  1.340
   64    67   317.000  1.510
   65    66   340.000  1.080
   65    71   317.000  1.510
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   268.000  1.529
   74    75   340.000  1.090
   74    76   268.000  1.529
   76    77   268.000  1.529
   76    80   268.000  1.529
   76    84   320.000  1.410
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    86   268.000  1.529
   86    87   340.000  1.090
   86    62   268.000  1.529
   86    88   320.000  1.410
   62    63   340.000  1.090
   88    89   214.000  1.327
   89    90   570.000  1.229
   89    91   320.000  1.462
   91    92   549.000  1.340
   91    94   317.000  1.510
   92    93   340.000  1.080
   92    98   317.000  1.510
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   84    85   553.000  0.945
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    43    70.00000  124.00000
   33    38    45    65.00000  117.92700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    43    44    65.00000  137.10300
   38    43    49    80.00000  120.01400
   38    45    46    35.00000  109.50000
   38    45    47    35.00000  109.50000
   38    45    48    35.00000  109.50000
   43    49    50    90.00000  111.18400
   49    43    44    65.00000  121.00000
   49    50    51    90.00000  108.74100
   49    50    62    50.00000  109.50000
   49    50    53    50.00000  109.50000
   50    51    52    80.00000  120.40000
   50    51    57    81.00000  111.40000
   50    62    58    58.35000  112.70000
   50    62    86    58.35000  112.70000
   50    62    63    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    55    37.50000  110.70000
   50    53    56    37.50000  110.70000
   51    57    58    83.00000  116.90000
   57    51    52    83.00000  123.40000
   57    58    59    35.00000  109.50000
   57    58    60    50.00000  109.50000
   57    58    62    50.00000  109.50000
   58    60    61    37.50000  110.70000
   58    60    64    70.00000  112.02700
   58    60    74    58.35000  112.70000
   58    62    86    58.35000  112.70000
   58    62    63    37.50000  110.70000
   60    58    59    37.50000  110.70000
   60    64    65    70.00000  124.00000
   60    64    67    65.00000  117.92700
   60    74    71    58.35000  112.70000
   60    74    75    37.50000  110.70000
   60    74    76    58.35000  112.70000
   64    60    61    35.00000  109.50000
   64    65    66    35.00000  120.00000
   64    65    71    70.00000  124.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    70    35.00000  109.50000
   65    71    72    35.00000  109.50000
   65    71    73    35.00000  109.50000
   65    71    74    70.00000  112.02700
   71    65    66    35.00000  117.00000
   71    74    75    37.50000  110.70000
   71    74    76    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    60    61    37.50000  110.70000
   74    60    64    70.00000  112.02700
   74    71    72    37.50000  110.70000
   74    71    73    37.50000  110.70000
   74    76    77    58.35000  112.70000
   74    76    80    58.35000  112.70000
   74    76    84    50.00000  109.50000
   76    74    75    37.50000  110.70000
   76    77    78    37.50000  110.70000
   76    77    79    37.50000  110.70000
   76    77    86    58.35000  112.70000
   76    80    81    37.50000  110.70000
   76    80    82    37.50000  110.70000
   76    80    83    37.50000  110.70000
   76    84    85    55.00000  108.50000
   77    86    87    37.50000  110.70000
   77    86    62    58.35000  112.70000
   77    86    88    50.00000  109.50000
   79    77    78    33.00000  107.80000
   86    77    78    37.50000  110.70000
   86    77    79    37.50000  110.70000
   86    62    63    37.50000  110.70000
   86    88    89    83.00000  116.90000
   62    50    51    63.00000  111.10000
   62    58    59    37.50000  110.70000
   62    58    60    58.35000  112.70000
   62    86    87    37.50000  110.70000
   88    86    87    35.00000  109.50000
   88    86    62    50.00000  109.50000
   88    89    90    83.00000  123.40000
   88    89    91    90.00000  111.29400
   89    91    92    65.00000  118.96000
   89    91    94    65.00000  116.34900
   91    89    90    80.00000  123.72100
   91    92    93    35.00000  120.00000
   91    92    98    70.00000  124.00000
   91    94    95    35.00000  109.50000
   91    94    96    35.00000  109.50000
   91    94    97    35.00000  109.50000
   92    98    99    35.00000  109.50000
   92    98   100    35.00000  109.50000
   92    98   101    35.00000  109.50000
   98    92    93    35.00000  117.00000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   94    91    92    70.00000  124.00000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   80    76    77    58.35000  112.70000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   84    76    77    50.00000  109.50000
   84    76    80    50.00000  109.50000
   67    64    65    70.00000  124.00000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   53    50    51    63.00000  111.10000
   53    50    62    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   45    38    43    70.00000  124.00000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    38    45   0.30250  1.0 1.0
   29    33    38    45  -0.14950 -1.0 2.0
   29    33    38    45   0.36900  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    49   7.00000 -1.0 2.0
   33    38    45    46   0.34800  1.0 3.0
   33    38    45    47   0.34800  1.0 3.0
   33    38    45    48   0.34800  1.0 3.0
   34    33    38    43   0.00000  1.0 1.0
   34    33    38    45   0.34800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    42   0.15000  1.0 3.0
   38    43    49    50  -2.26850  1.0 1.0
   38    43    49    50   3.39050 -1.0 2.0
   43    38    45    46   0.00000  1.0 1.0
   43    38    45    47   0.00000  1.0 1.0
   43    38    45    48   0.00000  1.0 1.0
   43    49    50    51  -0.48150  1.0 1.0
   43    49    50    51   0.09250 -1.0 2.0
   43    49    50    51  -0.12850  1.0 3.0
   43    49    50    62  -0.46850  1.0 1.0
   43    49    50    62   0.09300 -1.0 2.0
   43    49    50    62  -0.12850  1.0 3.0
   43    49    50    53  -0.46850  1.0 1.0
   43    49    50    53   0.09300 -1.0 2.0
   43    49    50    53  -0.12850  1.0 3.0
   44    43    49    50   2.00000 -1.0 2.0
   49    50    51    52   0.30150 -1.0 2.0
   49    50    51    57   0.40000  1.0 3.0
   49    50    62    58   0.62750  1.0 1.0
   49    50    62    58  -0.30950 -1.0 2.0
   49    50    62    58   0.27300  1.0 3.0
   49    50    62    86   0.62750  1.0 1.0
   49    50    62    86  -0.30950 -1.0 2.0
   49    50    62    86   0.27300  1.0 3.0
   49    50    62    63   0.23400  1.0 3.0
   49    50    53    54   0.23400  1.0 3.0
   49    50    53    55   0.23400  1.0 3.0
   49    50    53    56   0.23400  1.0 3.0
   50    51   -57    58   1.63150  1.0 1.0
   50    51   -57    58   2.92000 -1.0 2.0
   51    50   -62    58  -0.95700  1.0 1.0
   51    50   -62    58  -0.18200 -1.0 2.0
   51    50   -62    58   0.29450  1.0 3.0
   51    50    62    86  -0.95700  1.0 1.0
   51    50    62    86  -0.18200 -1.0 2.0
   51    50    62    86   0.29450  1.0 3.0
   51    50    62    63  -0.11250  1.0 3.0
   51    50    53    54  -0.11250  1.0 3.0
   51    50    53    55  -0.11250  1.0 3.0
   51    50    53    56  -0.11250  1.0 3.0
   51    57    58    59   0.08050  1.0 3.0
   51    57    58    60  -0.25900  1.0 1.0
   51    57    58    60  -0.47000 -1.0 2.0
   51    57    58    60   0.11750  1.0 3.0
   51    57   -58    62  -0.25900  1.0 1.0
   51    57   -58    62  -0.47000 -1.0 2.0
   51    57   -58    62   0.11750  1.0 3.0
   52    51    57    58   3.00000 -1.0 2.0
   57    58    60    61   0.23400  1.0 3.0
   57    58    60    64   0.61850  1.0 1.0
   57    58    60    64  -0.22750 -1.0 2.0
   57    58    60    64   0.15300  1.0 3.0
   57    58    60    74   0.62750  1.0 1.0
   57    58    60    74  -0.30950 -1.0 2.0
   57    58    60    74   0.27300  1.0 3.0
   57    58   -62    50   0.62750  1.0 1.0
   57    58   -62    50  -0.30950 -1.0 2.0
   57    58   -62    50   0.27300  1.0 3.0
   57    58    62    86   0.62750  1.0 1.0
   57    58    62    86  -0.30950 -1.0 2.0
   57    58    62    86   0.27300  1.0 3.0
   57    58    62    63   0.23400  1.0 3.0
   58    60    64    65   0.09850  1.0 1.0
   58    60    64    65   0.15250 -1.0 2.0
   58    60    64    65  -0.50650  1.0 3.0
   58    60    64    67   0.46850  1.0 1.0
   58    60    64    67   0.08550 -1.0 2.0
   58    60    64    67   0.09800  1.0 3.0
   58    60    74    71   0.56750  1.0 1.0
   58    60    74    71  -0.07550 -1.0 2.0
   58    60    74    71   0.20000  1.0 3.0
   58    60    74    75   0.15000  1.0 3.0
   58    60    74    76   0.56750  1.0 1.0
   58    60    74    76  -0.07550 -1.0 2.0
   58    60    74    76   0.20000  1.0 3.0
   59    58    60    61   0.15000  1.0 3.0
   59    58    60    64   0.15000  1.0 3.0
   59    58    60    74   0.15000  1.0 3.0
   59    58    62    50   0.15000  1.0 3.0
   59    58    62    86   0.15000  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   60    58    62    50   0.56750  1.0 1.0
   60    58    62    50  -0.07550 -1.0 2.0
   60    58    62    50   0.20000  1.0 3.0
   60    58    62    86   0.56750  1.0 1.0
   60    58    62    86  -0.07550 -1.0 2.0
   60    58    62    86   0.20000  1.0 3.0
   60    58    62    63   0.15000  1.0 3.0
   60    64    65    66   7.00000 -1.0 2.0
   60    64   -65    71   7.00000 -1.0 2.0
   60    64    67    68   0.34800  1.0 3.0
   60    64    67    69   0.34800  1.0 3.0
   60    64    67    70   0.34800  1.0 3.0
   60    74    76    77   0.56750  1.0 1.0
   60    74    76    77  -0.07550 -1.0 2.0
   60    74    76    77   0.20000  1.0 3.0
   60    74    76    80   0.56750  1.0 1.0
   60    74    76    80  -0.07550 -1.0 2.0
   60    74    76    80   0.20000  1.0 3.0
   60    74    76    84   0.86500  1.0 1.0
   60    74    76    84  -0.17500 -1.0 2.0
   60    74    76    84   0.20800  1.0 3.0
   61    60    64    65   0.00000  1.0 1.0
   61    60    64    67   0.34800  1.0 3.0
   61    60    74    71   0.15000  1.0 3.0
   61    60    74    75   0.15000  1.0 3.0
   61    60    74    76   0.15000  1.0 3.0
   64    60   -74    71   0.34400  1.0 1.0
   64    60   -74    71   0.09450 -1.0 2.0
   64    60   -74    71   0.11100  1.0 3.0
   64    60    74    75   0.15000  1.0 3.0
   64    60    74    76   0.34400  1.0 1.0
   64    60    74    76   0.09450 -1.0 2.0
   64    60    74    76   0.11100  1.0 3.0
   64    65    71    72   0.00000  1.0 1.0
   64    65    71    73   0.00000  1.0 1.0
   64    65   -71    74   0.09850  1.0 1.0
   64    65   -71    74   0.15250 -1.0 2.0
   64    65   -71    74  -0.50650  1.0 3.0
   65    64    67    68   0.00000  1.0 1.0
   65    64    67    69   0.00000  1.0 1.0
   65    64    67    70   0.00000  1.0 1.0
   65    71   -74    60   0.34400  1.0 1.0
   65    71   -74    60   0.09450 -1.0 2.0
   65    71   -74    60   0.11100  1.0 3.0
   65    71    74    75   0.15000  1.0 3.0
   65    71    74    76   0.34400  1.0 1.0
   65    71    74    76   0.09450 -1.0 2.0
   65    71    74    76   0.11100  1.0 3.0
   66    65    71    72   0.33100  1.0 3.0
   66    65    71    73   0.33100  1.0 3.0
   66    65    71    74   0.00000  1.0 1.0
   71    74    76    77   0.56750  1.0 1.0
   71    74    76    77  -0.07550 -1.0 2.0
   71    74    76    77   0.20000  1.0 3.0
   71    74    76    80   0.56750  1.0 1.0
   71    74    76    80  -0.07550 -1.0 2.0
   71    74    76    80   0.20000  1.0 3.0
   71    74    76    84   0.86500  1.0 1.0
   71    74    76    84  -0.17500 -1.0 2.0
   71    74    76    84   0.20800  1.0 3.0
   72    71    74    60   0.15000  1.0 3.0
   72    71    74    75   0.15000  1.0 3.0
   72    71    74    76   0.15000  1.0 3.0
   73    71    74    60   0.15000  1.0 3.0
   73    71    74    75   0.15000  1.0 3.0
   73    71    74    76   0.15000  1.0 3.0
   74    60   -64    65   0.09850  1.0 1.0
   74    60   -64    65   0.15250 -1.0 2.0
   74    60   -64    65  -0.50650  1.0 3.0
   74    60    64    67   0.46850  1.0 1.0
   74    60    64    67   0.08550 -1.0 2.0
   74    60    64    67   0.09800  1.0 3.0
   74    76    77    78   0.15000  1.0 3.0
   74    76    77    79   0.15000  1.0 3.0
   74    76    77    86   0.56750  1.0 1.0
   74    76    77    86  -0.07550 -1.0 2.0
   74    76    77    86   0.20000  1.0 3.0
   74    76    80    81   0.15000  1.0 3.0
   74    76    80    82   0.15000  1.0 3.0
   74    76    80    83   0.15000  1.0 3.0
   74    76    84    85  -0.11600  1.0 1.0
   74    76    84    85  -0.09450 -1.0 2.0
   74    76    84    85   0.21250  1.0 3.0
   75    74    76    77   0.15000  1.0 3.0
   75    74    76    80   0.15000  1.0 3.0
   75    74    76    84   0.23400  1.0 3.0
   76    77    86    87   0.15000  1.0 3.0
   76    77    86    62   0.56750  1.0 1.0
   76    77    86    62  -0.07550 -1.0 2.0
   76    77    86    62   0.20000  1.0 3.0
   76    77    86    88   0.62750  1.0 1.0
   76    77    86    88  -0.30950 -1.0 2.0
   76    77    86    88   0.27300  1.0 3.0
   77    76    80    81   0.15000  1.0 3.0
   77    76    80    82   0.15000  1.0 3.0
   77    76    80    83   0.15000  1.0 3.0
   77    76    84    85  -0.11600  1.0 1.0
   77    76    84    85  -0.09450 -1.0 2.0
   77    76    84    85   0.21250  1.0 3.0
   77    86    62    50   0.56750  1.0 1.0
   77    86    62    50  -0.07550 -1.0 2.0
   77    86    62    50   0.20000  1.0 3.0
   77    86    62    58   0.56750  1.0 1.0
   77    86    62    58  -0.07550 -1.0 2.0
   77    86    62    58   0.20000  1.0 3.0
   77    86    62    63   0.15000  1.0 3.0
   77    86    88    89  -0.25900  1.0 1.0
   77    86    88    89  -0.47000 -1.0 2.0
   77    86    88    89   0.11750  1.0 3.0
   78    77    86    87   0.15000  1.0 3.0
   78    77    86    62   0.15000  1.0 3.0
   78    77    86    88   0.23400  1.0 3.0
   79    77    86    87   0.15000  1.0 3.0
   79    77    86    62   0.15000  1.0 3.0
   79    77    86    88   0.23400  1.0 3.0
   86    88    89    90   3.00000 -1.0 2.0
   86    88    89    91   2.00000 -1.0 2.0
   87    86    62    50   0.15000  1.0 3.0
   87    86    62    58   0.15000  1.0 3.0
   87    86    62    63   0.15000  1.0 3.0
   87    86    88    89   0.08050  1.0 3.0
   62    50    51    52   0.30150 -1.0 2.0
   62    50   -51    57   0.36750  1.0 3.0
   62    50    53    54   0.15000  1.0 3.0
   62    50    53    55   0.15000  1.0 3.0
   62    50    53    56   0.15000  1.0 3.0
   62    58    60    61   0.15000  1.0 3.0
   62    58    60    64   0.34400  1.0 1.0
   62    58    60    64   0.09450 -1.0 2.0
   62    58    60    64   0.11100  1.0 3.0
   62    58    60    74   0.56750  1.0 1.0
   62    58    60    74  -0.07550 -1.0 2.0
   62    58    60    74   0.20000  1.0 3.0
   62    86    88    89  -0.25900  1.0 1.0
   62    86    88    89  -0.47000 -1.0 2.0
   62    86    88    89   0.11750  1.0 3.0
   88    86    62    50   0.62750  1.0 1.0
   88    86    62    50  -0.30950 -1.0 2.0
   88    86    62    50   0.27300  1.0 3.0
   88    86    62    58   0.62750  1.0 1.0
   88    86    62    58  -0.30950 -1.0 2.0
   88    86    62    58   0.27300  1.0 3.0
   88    86    62    63   0.23400  1.0 3.0
   88    89    91    92  -0.56150  1.0 1.0
   88    89    91    92   2.19150 -1.0 2.0
   88    89    91    94  -0.15000  1.0 1.0
   88    89    91    94   0.89550 -1.0 2.0
   88    89    91    94  -0.06900  1.0 3.0
   89    91    92    93   7.00000 -1.0 2.0
   89    91    92    98   7.00000 -1.0 2.0
   89    91    94    95   0.15000  1.0 3.0
   89    91    94    96   0.15000  1.0 3.0
   89    91    94    97   0.15000  1.0 3.0
   90    89    91    92   1.00000 -1.0 2.0
   90    89    91    94  -0.64400  1.0 1.0
   90    89    91    94   0.26850 -1.0 2.0
   91    92    98    99   0.00000  1.0 1.0
   91    92    98   100   0.00000  1.0 1.0
   91    92    98   101   0.00000  1.0 1.0
   92    91    94    95   0.00000  1.0 1.0
   92    91    94    96   0.00000  1.0 1.0
   92    91    94    97   0.00000  1.0 1.0
   93    92    98    99   0.33100  1.0 3.0
   93    92    98   100   0.33100  1.0 3.0
   93    92    98   101   0.33100  1.0 3.0
   94    91    92    93   7.00000 -1.0 2.0
   94    91    92    98   7.00000 -1.0 2.0
   80    76    77    78   0.15000  1.0 3.0
   80    76    77    79   0.15000  1.0 3.0
   80    76    77    86   0.56750  1.0 1.0
   80    76    77    86  -0.07550 -1.0 2.0
   80    76    77    86   0.20000  1.0 3.0
   80    76    84    85  -0.11600  1.0 1.0
   80    76    84    85  -0.09450 -1.0 2.0
   80    76    84    85   0.21250  1.0 3.0
   84    76    77    78   0.23400  1.0 3.0
   84    76    77    79   0.23400  1.0 3.0
   84    76    77    86   0.86500  1.0 1.0
   84    76    77    86  -0.17500 -1.0 2.0
   84    76    77    86   0.20800  1.0 3.0
   84    76    80    81   0.23400  1.0 3.0
   84    76    80    82   0.23400  1.0 3.0
   84    76    80    83   0.23400  1.0 3.0
   67    64    65    66   7.00000 -1.0 2.0
   67    64    65    71   7.00000 -1.0 2.0
   53    50    51    52   0.30150 -1.0 2.0
   53    50    51    57   0.36750  1.0 3.0
   53    50    62    58   0.56750  1.0 1.0
   53    50    62    58  -0.07550 -1.0 2.0
   53    50    62    58   0.20000  1.0 3.0
   53    50    62    86   0.56750  1.0 1.0
   53    50    62    86  -0.07550 -1.0 2.0
   53    50    62    86   0.20000  1.0 3.0
   53    50    62    63   0.15000  1.0 3.0
   45    38    43    44   7.00000 -1.0 2.0
   45    38    43    49   7.00000 -1.0 2.0
   39    33    38    43   0.09850  1.0 1.0
   39    33    38    43   0.15250 -1.0 2.0
   39    33    38    43  -0.50650  1.0 3.0
   39    33    38    45   0.46850  1.0 1.0
   39    33    38    45   0.08550 -1.0 2.0
   39    33    38    45   0.09800  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
   36    30    35    37  10.50000 -1.0 2.0
   33    45    38    43  15.00000 -1.0 2.0
   44    49    43    38  15.00000 -1.0 2.0
   50    57    51    52  10.50000 -1.0 2.0
   60    67    64    65   1.10000 -1.0 2.0
   71    66    65    64   1.10000 -1.0 2.0
   88    91    89    90  10.50000 -1.0 2.0
   89    94    91    92  15.00000 -1.0 2.0
   98    93    92    91  15.00000 -1.0 2.0
END
