* LIGAND DATABASE FILE (OPLS2005)
*
001     111   117    227    380     688
    1     0 S   NP   _N1_     1    30.33710    99.42011   -16.40231
    2     1 S   H    _HN1     2     1.02769    46.64266   -54.09017
    3     1 S   H    _H1_     3     1.02970    99.87041    51.94257
    4     1 S   H    _H2_     4     1.02830    66.96468   156.29679
    5     1 S   CT   _CA1     5     1.50202   148.51224  -111.31003
    6     5 S   HC   _HA1     6     1.09570   105.17970   -20.13114
    7     5 S   CO3  _C1_     7     1.53873   112.39393  -140.14209
    8     7 S   O2Z  _O11     8     1.26368   115.02144   -37.78578
    9     7 S   O2Z  _O12     9     1.26247   114.96424   141.20298
   10     5 S   CT   _CB1    10     1.53092   107.32684    97.79333
   11    10 S   HC   HB11    11     1.09811   109.33468   -48.71368
   12    10 S   HC   HB12    12     1.09804   110.29997    67.75885
   13    10 S   CT   _CG1    13     1.53038   112.89125  -169.95974
   14    13 S   HC   HG11    14     1.09474   110.25428   -60.57378
   15    13 S   HC   HG12    15     1.09616   110.27821    58.34451
   16    13 S   C    _CD1    16     1.51902   111.82425   177.96135
   17    16 S   O    _OE1    17     1.22788   122.81942   -24.07279
   18    16 S   N    _N2_    18     1.38564   112.12370   157.43081
   19    18 S   H    _HN2    19     1.01576   119.16689    -0.47064
   20    18 S   CT1  _CA2    20     1.46375   123.50269  -179.20623
   21    20 S   HC   _HA2    21     1.09758   109.21661   -15.66541
   22    20 S   C    _C2_    22     1.53543   108.27896  -131.04183
   23    22 S   O    _O2_    23     1.23002   122.34826  -147.98695
   24    20 S   CT   _CB2    32     1.54009   111.56293   106.51593
   25    24 S   HC   HB21    33     1.09034   108.45360    55.00707
   26    24 S   HC   HB22    34     1.09385   109.08156   173.82581
   27    22 S   N    _N3_    24     1.38555   113.33497    39.59871
   28    27 S   H    _HN3    25     1.01534   118.81582    -1.08101
   29    24 S   S    _SG2    35     1.82482   110.50535   -67.78279
   30    27 S   CT   _CA3    26     1.45462   123.68181   175.33541
   31    30 S   HC   HA31    27     1.09507   109.49949    18.32374
   32    30 S   HC   HA32    28     1.09505   107.03210   135.34685
   33    29 S   CT   _C15    36     1.91384   107.29306   164.31386
   34    30 S   CO3  _C3_    29     1.52913   113.04047  -105.36351
   35    34 S   O2Z  _O31    30     1.26413   115.40112   -44.50088
   36    34 S   O2Z  _O32    31     1.26357   115.00153   136.46615
   37    33 S   CT   _C16    37     1.60102   105.21882   168.67690
   38    37 S   HC   _H8_    38     1.09785   105.30918   171.96039
   39    33 S   CT   _C14    86     1.59597   116.45206    49.81519
   40    39 S   OM   _O42    87     1.32084   112.84863   -57.12641
   41    39 S   HC   _H7_    88     1.10061   104.42876   176.51328
   42    37 S   CT   _C21    39     1.54427   113.25306    58.13054
   43    42 S   HC   _H10    40     1.09313   110.48032  -100.61568
   44    37 S   CT   _C17    70     1.60484   116.43463   -76.06988
   45    42 S   CO4  _C22    41     1.51763   116.24822    20.46257
   46    45 S   O    _O37    42     1.23630   118.21347  -155.94469
   47    42 S   OH   _O41    68     1.42417   110.09059   141.06302
   48    47 S   HO   _H37    69     0.97326   107.37748   169.06449
   49    44 S   CT   _C18    71     1.56619   109.98447  -167.57596
   50    49 S   HC   _H21    72     1.09862   109.95958    47.66741
   51    49 S   HC   _H22    73     1.09703   110.68453   -68.54025
   52    44 S   CT   _C20   108     1.55265   113.74390    72.21429
   53    52 S   HC   _H23   109     1.08927   113.23500   -67.95881
   54    52 S   HC   _H24   110     1.09319   112.56003   173.96012
   55    52 S   HC   _H25   111     1.09294   112.19363    54.91047
   56    45 S   CT   _C23    43     1.53464   120.18938    28.57351
   57    49 S   CT   _C19    74     1.53483   113.69345   169.52713
   58    57 S   HC   _H9_    75     1.09558   109.42651    68.78323
   59    56 S   CT   _C27    44     1.56935   108.97402    81.30476
   60    59 S   HC   _H11    45     1.09948   108.74903   -35.41240
   61    56 S   CT   _C32    64     1.54910   108.09263  -157.82497
   62    61 S   HC   _H34    65     1.09548   111.98993  -173.86662
   63    61 S   HC   _H35    66     1.09382   110.82723    65.41038
   64    61 S   HC   _H36    67     1.09444   112.34562   -53.37393
   65    57 S   CT   _C10    76     1.52583   111.67603   -53.82664
   66    65 S   HC   _H5_    77     1.09859   109.98179   -65.20501
   67    59 S   CM   _C28    46     1.50622   118.21632    84.54610
   68    59 S   CT   _C26    55     1.52999   103.19860  -147.70154
   69    68 S   HC   _H28    56     1.09647   112.20423   -74.42571
   70    68 S   HC   _H29    57     1.09508   112.36976   163.32727
   71    65 S   CT   _C11    78     1.52818   111.51851    54.98948
   72    71 S   HC   _H17    79     1.09751   108.72652  -177.72531
   73    71 S   HC   _H18    80     1.09591   110.99087    66.89594
   74    65 S   OS   _O35    89     1.43082   108.93177   176.63850
   75    67 S   CM   _C29    47     1.33309   128.34631   111.70165
   76    75 S   HC   _H30    48     1.07601   128.89552    -1.99253
   77    68 S   CT   _C25    58     1.51846   102.26328    43.66732
   78    77 S   HC   _H26    59     1.09257   108.14900    76.89044
   79    77 S   HC   _H27    60     1.09566   110.01857  -165.66891
   80    44 S   CT   _C12    81     1.55930   107.74320   -51.13084
   81    80 S   HC   _H6_    82     1.10179   107.00040   -59.14204
   82    74 S   CO   _C9_    90     1.44133   110.94419    61.18081
   83    82 S   HC   _H4_    91     1.09693   105.75420  -174.92580
   84    75 S   CO4  _C30    49     1.46269   107.26568   176.83628
   85    84 S   O    _O38    50     1.21862   125.02913   179.79347
   86    33 S   CT   _C24    61     1.60187   109.25548   -77.16033
   87    80 S   CT   _C13    83     1.53464   112.24500    56.87887
   88    87 S   HC   _H19    84     1.09651   111.48971    61.45945
   89    87 S   HC   _H20    85     1.10063   108.15958   177.30332
   90    82 S   CO   _C8_    92     1.54446   110.32372   -55.82291
   91    84 S   OS   _O39    51     1.36152   109.02501    -1.01664
   92    86 S   OH   _O40    62     1.43936   109.09057    61.94555
   93    92 S   HO   _H33    63     0.97588   106.90133    48.48006
   94    90 S   CO4  _C7_    93     1.52426   109.63558   169.07863
   95    94 S   O    _O33    94     1.23087   122.24444   139.09107
   96    57 S   OS   _O36   105     1.43402   109.46762  -174.30199
   97    90 S   OH   _O43   106     1.42212   109.35891   -71.63300
   98    97 S   HO   _H38   107     0.97312   107.19655  -161.03918
   99    67 S   CT   _C31    52     1.48304   121.48860   -71.77547
  100    99 S   HC   _H31    53     1.09391   112.19289   -58.36405
  101    99 S   HC   _H32    54     1.09139   112.99351    66.61463
  102    94 S   CT   _C6_    95     1.50743   116.22537   -43.87998
  103   102 S   HC   _H15    96     1.09473   109.42912   171.31676
  104   102 S   HC   _H16    97     1.09564   107.59461   -70.55807
  105   102 S   CT   _C5_    98     1.52197   108.18952    50.32646
  106   105 S   HC   _H3_    99     1.09757   110.89089    61.44269
  107    82 S   OS   _O34   100     1.43444   109.94131    68.72689
  108   105 S   CT   _C4_   101     1.52203   110.93033  -177.40625
  109   108 S   HC   _H12   102     1.09571   111.05832    60.72774
  110   108 S   HC   _H13   103     1.09419   111.33421   -60.62358
  111   108 S   HC   _H14   104     1.09542   110.33532   178.73421
  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  13   5   4   3
  26   2   1   1  27  10  14   6   5  13   6  22  15   5   2   1
  17   7   6   8   3   2   1  18  13   6  21   9   8   3   2   1
  13   7  13   9   5   4  10   5   4   9   7   4   5   3   2   4
   3  12   6   5   2   3   2   1   1  10   3   1   1  11   6   4
   3   1   2   1   1   9   5   4   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    86    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    56    77    86    92    44    87    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    45    56    59    68    77    78    79    86    92    93    61    47    44    49    80    87    88    89    39    40    41    52  
   35    36  
   36  
    0  
   38    42    43    45    46    56    77    86    92    47    48    44    49    50    51    57    71    80    81    87    39    40    41    52    53    54    55  
   42    43    45    86    47    44    49    80    39    52  
   40    41    42    44    56    71    77    80    81    86    87    88    89    92  
   41    80    86    87    88    89  
   80    86    87    88    89  
   43    45    46    56    59    86    61    47    48    44    49    80    52  
   45    46    56    47    48    44  
   49    50    51    57    58    65    71    72    73    80    81    87    88    89    96    52    53    54    55    45    47    86  
   46    56    59    60    67    68    77    86    92    61    62    63    64    47    48  
   56    59    86    61    47  
   48    56  
    0  
   50    51    57    58    65    66    71    80    81    87    74    90    96    52    53    54    55  
   51    57    58    65    80    96    52  
   57    58    65    80    96    52  
   53    54    55    57    71    80    81    87  
   54    55    80  
   55    80  
   80  
   59    60    67    75    99    68    69    70    77    78    79    86    92    93    61    62    63    64  
   58    65    66    71    72    73    80    74    82    90    94    96    97  
   65    66    71    74    90    96  
   60    67    75    76    84    91    99   100   101    68    69    70    77    78    79    86    92    61    62    63    64  
   67    75    99    68    69    70    77    86    61  
   62    63    64    67    68    77    86    92  
   63    64    86  
   64    86  
   86  
   66    71    72    73    80    81    87    74    82    83    90   107    96  
   71    72    73    80    74    82    96  
   75    76    84    85    91    99   100   101    68    69    70    77    86  
   69    70    77    78    79    86    92    75    99  
   70    77    78    79    86  
   77    78    79    86  
   72    73    80    81    87    88    89    74    82    96  
   73    80    81    87    74  
   80    81    87    74  
   82    83    90    94   105   107    96    97    80  
   76    84    85    91    99   100   101  
   84    85    91    99  
   78    79    86    92    93  
   79    86    92  
   86    92  
   81    87    88    89  
   87    88    89  
   83    90    94    95   102   105   106   107   108    96    97    98  
   90    94   105   107    96    97  
   85    91    99   100   101  
   91    99  
   92    93    87  
   88    89  
   89  
    0  
   94    95   102   103   104   105   107    96    97    98  
   99   100   101  
   93  
    0  
   95   102   103   104   105   106   107   108    96    97    98  
  102   103   104   105    96    97  
   97    98   102   107  
   98   102   107  
    0  
  100   101  
  101  
    0  
  103   104   105   106   107   108   109   110   111  
  104   105   106   107   108  
  105   106   107   108  
  106   107   108   109   110   111  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111  
  110   111  
  111  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   41   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   57   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   75   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   76   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.120000   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   84   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   85   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   86   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   91   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   92   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   93   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   94   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   96   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   97   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   98   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   99   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  101   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  107   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   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   268.000  1.529
   33    86   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    42   268.000  1.529
   37    44   268.000  1.529
   42    43   340.000  1.090
   42    45   317.000  1.522
   42    47   320.000  1.410
   45    46   570.000  1.229
   45    56   317.000  1.522
   56    59   268.000  1.529
   56    86   268.000  1.529
   56    61   268.000  1.529
   59    60   340.000  1.090
   59    67   317.000  1.510
   59    68   268.000  1.529
   67    75   549.000  1.340
   67    99   317.000  1.510
   75    76   340.000  1.080
   75    84   320.000  1.462
   84    85   570.000  1.229
   84    91   214.000  1.327
   91    99   320.000  1.410
   99   100   340.000  1.090
   99   101   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    77   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    86   268.000  1.529
   86    92   320.000  1.410
   92    93   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   47    48   553.000  0.945
   44    49   268.000  1.529
   44    80   268.000  1.529
   44    52   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    57   268.000  1.529
   57    58   340.000  1.090
   57    65   268.000  1.529
   57    96   320.000  1.410
   65    66   340.000  1.090
   65    71   268.000  1.529
   65    74   320.000  1.410
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    80   268.000  1.529
   80    81   340.000  1.090
   80    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    39   268.000  1.529
   39    40   570.000  1.307
   39    41   340.000  1.090
   74    82   320.000  1.380
   82    83   340.000  1.090
   82    90   250.000  1.527
   82   107   320.000  1.380
   90    94   235.000  1.518
   90    96   320.000  1.380
   90    97   380.000  1.407
   94    95   570.000  1.229
   94   102   317.000  1.522
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   320.000  1.410
  105   108   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
   97    98   553.000  0.945
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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  111.63000
   29    33    86    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    42    58.35000  112.70000
   33    37    44    58.35000  112.70000
   33    86    56    58.35000  112.70000
   33    86    77    58.35000  112.70000
   33    86    92    50.00000  109.50000
   33    39    87    58.35000  112.70000
   33    39    40    50.00000  109.50000
   33    39    41    37.50000  110.70000
   37    42    43    37.50000  110.70000
   37    42    45    63.00000  111.10000
   37    42    47    50.00000  109.50000
   37    44    49    58.35000  112.70000
   37    44    80    58.35000  112.70000
   37    44    52    58.35000  112.70000
   42    37    38    37.50000  110.70000
   42    45    46    80.00000  120.40000
   42    45    56    70.00000  116.00000
   42    47    48    55.00000  108.50000
   45    42    43    35.00000  109.50000
   45    56    59    63.00000  111.10000
   45    56    86    63.00000  111.10000
   45    56    61    63.00000  111.10000
   56    45    46    80.00000  120.40000
   56    59    60    37.50000  110.70000
   56    59    67    70.00000  112.02700
   56    59    68    58.35000  112.70000
   56    86    77    58.35000  112.70000
   56    86    92    50.00000  109.50000
   56    61    62    37.50000  110.70000
   56    61    63    37.50000  110.70000
   56    61    64    37.50000  110.70000
   59    67    75    70.00000  124.00000
   59    67    99    65.00000  117.92700
   59    68    69    37.50000  110.70000
   59    68    70    37.50000  110.70000
   59    68    77    58.35000  112.70000
   67    59    60    35.00000  109.50000
   67    75    76    35.00000  120.00000
   67    75    84    65.00000  118.96000
   67    99    91    85.00000  110.90400
   67    99   100    35.00000  109.50000
   67    99   101    35.00000  109.50000
   75    84    85    80.00000  123.72100
   75    84    91    90.00000  111.29400
   84    75    76    40.00000  117.72500
   84    91    99    83.00000  116.90000
   91    84    85    83.00000  123.40000
   91    99   100    35.00000  109.50000
   91    99   101    35.00000  109.50000
   99    67    75    70.00000  124.00000
  101    99   100    33.00000  107.80000
   68    59    60    37.50000  110.70000
   68    59    67    70.00000  112.02700
   68    77    78    37.50000  110.70000
   68    77    79    37.50000  110.70000
   68    77    86    58.35000  112.70000
   70    68    69    33.00000  107.80000
   77    68    69    37.50000  110.70000
   77    68    70    37.50000  110.70000
   77    86    92    50.00000  109.50000
   79    77    78    33.00000  107.80000
   86    33    37    58.35000  112.70000
   86    56    59    58.35000  112.70000
   86    77    78    37.50000  110.70000
   86    77    79    37.50000  110.70000
   86    92    93    55.00000  108.50000
   61    56    59    58.35000  112.70000
   61    56    86    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   47    42    43    35.00000  109.50000
   47    42    45    90.00000  109.61100
   44    37    38    37.50000  110.70000
   44    37    42    58.35000  112.70000
   44    49    50    37.50000  110.70000
   44    49    51    37.50000  110.70000
   44    49    57    58.35000  112.70000
   44    80    71    58.35000  112.70000
   44    80    81    37.50000  110.70000
   44    80    87    58.35000  112.70000
   44    52    53    37.50000  110.70000
   44    52    54    37.50000  110.70000
   44    52    55    37.50000  110.70000
   49    57    58    37.50000  110.70000
   49    57    65    58.35000  112.70000
   49    57    96    50.00000  109.50000
   51    49    50    33.00000  107.80000
   57    49    50    37.50000  110.70000
   57    49    51    37.50000  110.70000
   57    65    66    37.50000  110.70000
   57    65    71    58.35000  112.70000
   57    65    74    50.00000  109.50000
   57    96    90    60.00000  109.50000
   65    57    58    37.50000  110.70000
   65    71    72    37.50000  110.70000
   65    71    73    37.50000  110.70000
   65    71    80    58.35000  112.70000
   65    74    82    60.00000  109.50000
   71    65    66    37.50000  110.70000
   71    80    81    37.50000  110.70000
   71    80    87    58.35000  112.70000
   73    71    72    33.00000  107.80000
   80    44    49    58.35000  112.70000
   80    71    72    37.50000  110.70000
   80    71    73    37.50000  110.70000
   80    87    88    37.50000  110.70000
   80    87    89    37.50000  110.70000
   80    87    39    58.35000  112.70000
   87    80    81    37.50000  110.70000
   87    39    40    50.00000  109.50000
   87    39    41    37.50000  110.70000
   89    87    88    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    86    58.35000  112.70000
   39    87    88    37.50000  110.70000
   39    87    89    37.50000  110.70000
   41    39    40    45.00000  125.66300
   74    65    66    35.00000  109.50000
   74    65    71    50.00000  109.50000
   74    82    83    35.00000  109.50000
   74    82    90    90.00000  108.56700
   74    82   107    92.60000  111.55000
   82    90    94    65.00000  114.32000
   82    90    96    90.00000  108.56700
   82    90    97    90.00000  110.19100
   82   107   105    60.00000  109.50000
   90    82    83    45.00000  112.01100
   90    94    95    75.00000  120.68000
   90    94   102    70.00000  116.00000
   90    97    98    70.00000  107.92000
   94   102   103    35.00000  109.50000
   94   102   104    35.00000  109.50000
   94   102   105    63.00000  111.10000
  102    94    95    80.00000  120.40000
  102   105   106    37.50000  110.70000
  102   105   107    50.00000  109.50000
  102   105   108    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  105   108   109    37.50000  110.70000
  105   108   110    37.50000  110.70000
  105   108   111    37.50000  110.70000
  107    82    83    35.00000  109.50000
  107    82    90    90.00000  108.56700
  107   105   106    35.00000  109.50000
  108   105   106    37.50000  110.70000
  108   105   107    50.00000  109.50000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
   96    57    58    35.00000  109.50000
   96    57    65    50.00000  109.50000
   96    90    94    90.00000  107.81500
   97    90    94    90.00000  109.61100
   97    90    96   110.00000  112.08000
   52    44    49    58.35000  112.70000
   52    44    80    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    86   0.01700  1.0 1.0
   24    29    33    86  -0.23550 -1.0 2.0
   24    29    33    86   0.21350  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    37    38   0.15000  1.0 3.0
   29    33    37    42   0.44750  1.0 1.0
   29    33    37    42  -0.17800 -1.0 2.0
   29    33    37    42   0.20200  1.0 3.0
   29    33    37    44   0.44750  1.0 1.0
   29    33    37    44  -0.17800 -1.0 2.0
   29    33    37    44   0.20200  1.0 3.0
   29    33    86    56   0.44750  1.0 1.0
   29    33    86    56  -0.17800 -1.0 2.0
   29    33    86    56   0.20200  1.0 3.0
   29    33    86    77   0.44750  1.0 1.0
   29    33    86    77  -0.17800 -1.0 2.0
   29    33    86    77   0.20200  1.0 3.0
   29    33    86    92   0.56750  1.0 1.0
   29    33    86    92  -0.07550 -1.0 2.0
   29    33    86    92   0.20000  1.0 3.0
   29    33    39    87   0.44750  1.0 1.0
   29    33    39    87  -0.17800 -1.0 2.0
   29    33    39    87   0.20200  1.0 3.0
   29    33    39    40   0.56750  1.0 1.0
   29    33    39    40  -0.07550 -1.0 2.0
   29    33    39    40   0.20000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37    42    43   0.15000  1.0 3.0
   33    37    42    45  -0.95700  1.0 1.0
   33    37    42    45  -0.18200 -1.0 2.0
   33    37    42    45   0.29450  1.0 3.0
   33    37    42    47   0.86500  1.0 1.0
   33    37    42    47  -0.17500 -1.0 2.0
   33    37    42    47   0.20800  1.0 3.0
   33    37    44    49   0.56750  1.0 1.0
   33    37    44    49  -0.07550 -1.0 2.0
   33    37    44    49   0.20000  1.0 3.0
   33    37    44    80   0.56750  1.0 1.0
   33    37    44    80  -0.07550 -1.0 2.0
   33    37    44    80   0.20000  1.0 3.0
   33    37    44    52   0.56750  1.0 1.0
   33    37    44    52  -0.07550 -1.0 2.0
   33    37    44    52   0.20000  1.0 3.0
   33    86    92    93  -0.11600  1.0 1.0
   33    86    92    93  -0.09450 -1.0 2.0
   33    86    92    93   0.21250  1.0 3.0
   37    33    86    56   0.56750  1.0 1.0
   37    33    86    56  -0.07550 -1.0 2.0
   37    33    86    56   0.20000  1.0 3.0
   37    33    86    77   0.56750  1.0 1.0
   37    33    86    77  -0.07550 -1.0 2.0
   37    33    86    77   0.20000  1.0 3.0
   37    33    86    92   0.86500  1.0 1.0
   37    33    86    92  -0.17500 -1.0 2.0
   37    33    86    92   0.20800  1.0 3.0
   37    33    39    87   0.56750  1.0 1.0
   37    33    39    87  -0.07550 -1.0 2.0
   37    33    39    87   0.20000  1.0 3.0
   37    33    39    40   0.62750  1.0 1.0
   37    33    39    40  -0.30950 -1.0 2.0
   37    33    39    40   0.27300  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    42    45    46   0.30150 -1.0 2.0
   37    42   -45    56   0.60050  1.0 1.0
   37    42   -45    56   0.05600 -1.0 2.0
   37    42   -45    56   0.26150  1.0 3.0
   37    42    47    48  -0.11600  1.0 1.0
   37    42    47    48  -0.09450 -1.0 2.0
   37    42    47    48   0.21250  1.0 3.0
   37    44    49    50   0.15000  1.0 3.0
   37    44    49    51   0.15000  1.0 3.0
   37    44    49    57   0.56750  1.0 1.0
   37    44    49    57  -0.07550 -1.0 2.0
   37    44    49    57   0.20000  1.0 3.0
   37    44    80    71   0.56750  1.0 1.0
   37    44    80    71  -0.07550 -1.0 2.0
   37    44    80    71   0.20000  1.0 3.0
   37    44    80    81   0.15000  1.0 3.0
   37    44   -80    87   0.56750  1.0 1.0
   37    44   -80    87  -0.07550 -1.0 2.0
   37    44   -80    87   0.20000  1.0 3.0
   37    44    52    53   0.15000  1.0 3.0
   37    44    52    54   0.15000  1.0 3.0
   37    44    52    55   0.15000  1.0 3.0
   38    37    42    43   0.15000  1.0 3.0
   38    37    42    45  -0.11250  1.0 3.0
   38    37    42    47   0.23400  1.0 3.0
   38    37    44    49   0.15000  1.0 3.0
   38    37    44    80   0.15000  1.0 3.0
   38    37    44    52   0.15000  1.0 3.0
   42    37    44    49   0.56750  1.0 1.0
   42    37    44    49  -0.07550 -1.0 2.0
   42    37    44    49   0.20000  1.0 3.0
   42    37    44    80   0.56750  1.0 1.0
   42    37    44    80  -0.07550 -1.0 2.0
   42    37    44    80   0.20000  1.0 3.0
   42    37    44    52   0.56750  1.0 1.0
   42    37    44    52  -0.07550 -1.0 2.0
   42    37    44    52   0.20000  1.0 3.0
   42    45    56    59   0.60050  1.0 1.0
   42    45    56    59   0.05600 -1.0 2.0
   42    45    56    59   0.26150  1.0 3.0
   42    45    56    86   0.60050  1.0 1.0
   42    45    56    86   0.05600 -1.0 2.0
   42    45    56    86   0.26150  1.0 3.0
   42    45    56    61   0.60050  1.0 1.0
   42    45    56    61   0.05600 -1.0 2.0
   42    45    56    61   0.26150  1.0 3.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    56   0.00000  1.0 1.0
   43    42    47    48   0.19450  1.0 3.0
   45    42    47    48   0.91850  1.0 1.0
   45    42    47    48   0.57950  1.0 3.0
   45    56    59    60  -0.11250  1.0 3.0
   45    56    59    67  -0.98800  1.0 1.0
   45    56    59    67   0.48800 -1.0 2.0
   45    56    59    67   0.76800  1.0 3.0
   45    56    59    68  -0.95700  1.0 1.0
   45    56    59    68  -0.18200 -1.0 2.0
   45    56    59    68   0.29450  1.0 3.0
   45    56   -86    33  -0.95700  1.0 1.0
   45    56   -86    33  -0.18200 -1.0 2.0
   45    56   -86    33   0.29450  1.0 3.0
   45    56    86    77  -0.95700  1.0 1.0
   45    56    86    77  -0.18200 -1.0 2.0
   45    56    86    77   0.29450  1.0 3.0
   45    56    86    92  -0.09450  1.0 1.0
   45    56    86    92  -1.12950 -1.0 2.0
   45    56    86    92   0.54000  1.0 3.0
   45    56    61    62  -0.11250  1.0 3.0
   45    56    61    63  -0.11250  1.0 3.0
   45    56    61    64  -0.11250  1.0 3.0
   46    45    56    59   0.30150 -1.0 2.0
   46    45    56    86   0.30150 -1.0 2.0
   46    45    56    61   0.30150 -1.0 2.0
   56    59    67    75   0.09850  1.0 1.0
   56    59    67    75   0.15250 -1.0 2.0
   56    59    67    75  -0.50650  1.0 3.0
   56    59    67    99   0.46850  1.0 1.0
   56    59    67    99   0.08550 -1.0 2.0
   56    59    67    99   0.09800  1.0 3.0
   56    59    68    69   0.15000  1.0 3.0
   56    59    68    70   0.15000  1.0 3.0
   56    59   -68    77   0.56750  1.0 1.0
   56    59   -68    77  -0.07550 -1.0 2.0
   56    59   -68    77   0.20000  1.0 3.0
   56    86    92    93  -0.11600  1.0 1.0
   56    86    92    93  -0.09450 -1.0 2.0
   56    86    92    93   0.21250  1.0 3.0
   59    56    86    33   0.56750  1.0 1.0
   59    56    86    33  -0.07550 -1.0 2.0
   59    56    86    33   0.20000  1.0 3.0
   59    56   -86    77   0.56750  1.0 1.0
   59    56   -86    77  -0.07550 -1.0 2.0
   59    56   -86    77   0.20000  1.0 3.0
   59    56    86    92   0.86500  1.0 1.0
   59    56    86    92  -0.17500 -1.0 2.0
   59    56    86    92   0.20800  1.0 3.0
   59    56    61    62   0.15000  1.0 3.0
   59    56    61    63   0.15000  1.0 3.0
   59    56    61    64   0.15000  1.0 3.0
   59    67    75    76   7.00000 -1.0 2.0
   59    67    75    84   7.00000 -1.0 2.0
   59    67    99    91   0.09700  1.0 1.0
   59    67    99    91   0.15600 -1.0 2.0
   59    67    99    91  -0.50800  1.0 3.0
   59    67    99   100   0.34800  1.0 3.0
   59    67    99   101   0.34800  1.0 3.0
   59    68    77    78   0.15000  1.0 3.0
   59    68    77    79   0.15000  1.0 3.0
   59    68   -77    86   0.56750  1.0 1.0
   59    68   -77    86  -0.07550 -1.0 2.0
   59    68   -77    86   0.20000  1.0 3.0
   60    59    67    75   0.00000  1.0 1.0
   60    59    67    99   0.34800  1.0 3.0
   60    59    68    69   0.15000  1.0 3.0
   60    59    68    70   0.15000  1.0 3.0
   60    59    68    77   0.15000  1.0 3.0
   67    59    68    69   0.15000  1.0 3.0
   67    59    68    70   0.15000  1.0 3.0
   67    59    68    77   0.34400  1.0 1.0
   67    59    68    77   0.09450 -1.0 2.0
   67    59    68    77   0.11100  1.0 3.0
   67    75    84    85   1.00000 -1.0 2.0
   67    75   -84    91  -0.56150  1.0 1.0
   67    75   -84    91   2.19150 -1.0 2.0
   75    67   -99    91   0.39000  1.0 1.0
   75    67   -99    91  -0.05800 -1.0 2.0
   75    67   -99    91  -0.55150  1.0 3.0
   75    67    99   100   0.00000  1.0 1.0
   75    67    99   101   0.00000  1.0 1.0
   75    84   -91    99   2.00000 -1.0 2.0
   76    75    84    85   0.00000  1.0 1.0
   76    75    84    91   1.63100 -1.0 2.0
   84    91   -99    67  -0.82050  1.0 1.0
   84    91   -99    67   0.00600 -1.0 2.0
   84    91   -99    67   0.04400  1.0 3.0
   84    91    99   100   0.08050  1.0 3.0
   84    91    99   101   0.08050  1.0 3.0
   85    84    91    99   3.00000 -1.0 2.0
   99    67    75    76   7.00000 -1.0 2.0
   99    67   -75    84   7.00000 -1.0 2.0
   68    59    67    75   0.09850  1.0 1.0
   68    59    67    75   0.15250 -1.0 2.0
   68    59    67    75  -0.50650  1.0 3.0
   68    59    67    99   0.46850  1.0 1.0
   68    59    67    99   0.08550 -1.0 2.0
   68    59    67    99   0.09800  1.0 3.0
   68    77    86    33   0.56750  1.0 1.0
   68    77    86    33  -0.07550 -1.0 2.0
   68    77    86    33   0.20000  1.0 3.0
   68    77   -86    56   0.56750  1.0 1.0
   68    77   -86    56  -0.07550 -1.0 2.0
   68    77   -86    56   0.20000  1.0 3.0
   68    77    86    92   0.86500  1.0 1.0
   68    77    86    92  -0.17500 -1.0 2.0
   68    77    86    92   0.20800  1.0 3.0
   69    68    77    78   0.15000  1.0 3.0
   69    68    77    79   0.15000  1.0 3.0
   69    68    77    86   0.15000  1.0 3.0
   70    68    77    78   0.15000  1.0 3.0
   70    68    77    79   0.15000  1.0 3.0
   70    68    77    86   0.15000  1.0 3.0
   77    86    92    93  -0.11600  1.0 1.0
   77    86    92    93  -0.09450 -1.0 2.0
   77    86    92    93   0.21250  1.0 3.0
   78    77    86    33   0.15000  1.0 3.0
   78    77    86    56   0.15000  1.0 3.0
   78    77    86    92   0.23400  1.0 3.0
   79    77    86    33   0.15000  1.0 3.0
   79    77    86    56   0.15000  1.0 3.0
   79    77    86    92   0.23400  1.0 3.0
   86    33    37    38   0.15000  1.0 3.0
   86    33   -37    42   0.56750  1.0 1.0
   86    33   -37    42  -0.07550 -1.0 2.0
   86    33   -37    42   0.20000  1.0 3.0
   86    33    37    44   0.56750  1.0 1.0
   86    33    37    44  -0.07550 -1.0 2.0
   86    33    37    44   0.20000  1.0 3.0
   86    33    39    87   0.56750  1.0 1.0
   86    33    39    87  -0.07550 -1.0 2.0
   86    33    39    87   0.20000  1.0 3.0
   86    33    39    40   0.62750  1.0 1.0
   86    33    39    40  -0.30950 -1.0 2.0
   86    33    39    40   0.27300  1.0 3.0
   86    33    39    41   0.15000  1.0 3.0
   86    56    59    60   0.15000  1.0 3.0
   86    56    59    67   0.34400  1.0 1.0
   86    56    59    67   0.09450 -1.0 2.0
   86    56    59    67   0.11100  1.0 3.0
   86    56   -59    68   0.56750  1.0 1.0
   86    56   -59    68  -0.07550 -1.0 2.0
   86    56   -59    68   0.20000  1.0 3.0
   86    56    61    62   0.15000  1.0 3.0
   86    56    61    63   0.15000  1.0 3.0
   86    56    61    64   0.15000  1.0 3.0
   61    56    59    60   0.15000  1.0 3.0
   61    56    59    67   0.34400  1.0 1.0
   61    56    59    67   0.09450 -1.0 2.0
   61    56    59    67   0.11100  1.0 3.0
   61    56    59    68   0.56750  1.0 1.0
   61    56    59    68  -0.07550 -1.0 2.0
   61    56    59    68   0.20000  1.0 3.0
   61    56    86    33   0.56750  1.0 1.0
   61    56    86    33  -0.07550 -1.0 2.0
   61    56    86    33   0.20000  1.0 3.0
   61    56    86    77   0.56750  1.0 1.0
   61    56    86    77  -0.07550 -1.0 2.0
   61    56    86    77   0.20000  1.0 3.0
   61    56    86    92   0.86500  1.0 1.0
   61    56    86    92  -0.17500 -1.0 2.0
   61    56    86    92   0.20800  1.0 3.0
   47    42    45    46   0.30150 -1.0 2.0
   47    42    45    56   0.55300  1.0 1.0
   47    42    45    56   1.25850 -1.0 2.0
   47    42    45    56  -0.23600  1.0 3.0
   44    37    42    43   0.15000  1.0 3.0
   44    37    42    45  -0.95700  1.0 1.0
   44    37    42    45  -0.18200 -1.0 2.0
   44    37    42    45   0.29450  1.0 3.0
   44    37    42    47   0.86500  1.0 1.0
   44    37    42    47  -0.17500 -1.0 2.0
   44    37    42    47   0.20800  1.0 3.0
   44    49    57    58   0.15000  1.0 3.0
   44    49    57    65   0.56750  1.0 1.0
   44    49    57    65  -0.07550 -1.0 2.0
   44    49    57    65   0.20000  1.0 3.0
   44    49    57    96   0.62750  1.0 1.0
   44    49    57    96  -0.30950 -1.0 2.0
   44    49    57    96   0.27300  1.0 3.0
   44    80    87    88   0.15000  1.0 3.0
   44    80    87    89   0.15000  1.0 3.0
   44    80    87    39   0.56750  1.0 1.0
   44    80    87    39  -0.07550 -1.0 2.0
   44    80    87    39   0.20000  1.0 3.0
   49    44    80    71   0.56750  1.0 1.0
   49    44    80    71  -0.07550 -1.0 2.0
   49    44    80    71   0.20000  1.0 3.0
   49    44    80    81   0.15000  1.0 3.0
   49    44    80    87   0.56750  1.0 1.0
   49    44    80    87  -0.07550 -1.0 2.0
   49    44    80    87   0.20000  1.0 3.0
   49    44    52    53   0.15000  1.0 3.0
   49    44    52    54   0.15000  1.0 3.0
   49    44    52    55   0.15000  1.0 3.0
   49    57    65    66   0.15000  1.0 3.0
   49    57   -65    71   0.56750  1.0 1.0
   49    57   -65    71  -0.07550 -1.0 2.0
   49    57   -65    71   0.20000  1.0 3.0
   49    57    65    74   0.62750  1.0 1.0
   49    57    65    74  -0.30950 -1.0 2.0
   49    57    65    74   0.27300  1.0 3.0
   49    57    96    90   0.06250  1.0 1.0
   49    57    96    90  -0.01100 -1.0 2.0
   49    57    96    90   0.28050  1.0 3.0
   50    49    57    58   0.15000  1.0 3.0
   50    49    57    65   0.15000  1.0 3.0
   50    49    57    96   0.23400  1.0 3.0
   51    49    57    58   0.15000  1.0 3.0
   51    49    57    65   0.15000  1.0 3.0
   51    49    57    96   0.23400  1.0 3.0
   57    65    71    72   0.15000  1.0 3.0
   57    65    71    73   0.15000  1.0 3.0
   57    65    71    80   0.56750  1.0 1.0
   57    65    71    80  -0.07550 -1.0 2.0
   57    65    71    80   0.20000  1.0 3.0
   57    65    74    82   0.06250  1.0 1.0
   57    65    74    82  -0.01100 -1.0 2.0
   57    65    74    82   0.28050  1.0 3.0
   58    57    65    66   0.15000  1.0 3.0
   58    57    65    71   0.15000  1.0 3.0
   58    57    65    74   0.23400  1.0 3.0
   58    57    96    90   0.37050  1.0 3.0
   65    57    96    90   0.06250  1.0 1.0
   65    57    96    90  -0.01100 -1.0 2.0
   65    57    96    90   0.28050  1.0 3.0
   65    71   -80    44   0.56750  1.0 1.0
   65    71   -80    44  -0.07550 -1.0 2.0
   65    71   -80    44   0.20000  1.0 3.0
   65    71    80    81   0.15000  1.0 3.0
   65    71    80    87   0.56750  1.0 1.0
   65    71    80    87  -0.07550 -1.0 2.0
   65    71    80    87   0.20000  1.0 3.0
   65    74    82    83   0.37050  1.0 3.0
   65    74   -82    90   0.06250  1.0 1.0
   65    74   -82    90  -0.01100 -1.0 2.0
   65    74   -82    90   0.28050  1.0 3.0
   65    74    82   107  -0.53350  1.0 1.0
   65    74    82   107  -0.78350 -1.0 2.0
   65    74    82   107   0.33750  1.0 3.0
   66    65    71    72   0.15000  1.0 3.0
   66    65    71    73   0.15000  1.0 3.0
   66    65    71    80   0.15000  1.0 3.0
   66    65    74    82   0.37050  1.0 3.0
   71    65    74    82   0.06250  1.0 1.0
   71    65    74    82  -0.01100 -1.0 2.0
   71    65    74    82   0.28050  1.0 3.0
   71    80    87    88   0.15000  1.0 3.0
   71    80    87    89   0.15000  1.0 3.0
   71    80    87    39   0.56750  1.0 1.0
   71    80    87    39  -0.07550 -1.0 2.0
   71    80    87    39   0.20000  1.0 3.0
   72    71    80    44   0.15000  1.0 3.0
   72    71    80    81   0.15000  1.0 3.0
   72    71    80    87   0.15000  1.0 3.0
   73    71    80    44   0.15000  1.0 3.0
   73    71    80    81   0.15000  1.0 3.0
   73    71    80    87   0.15000  1.0 3.0
   80    44    49    50   0.15000  1.0 3.0
   80    44    49    51   0.15000  1.0 3.0
   80    44   -49    57   0.56750  1.0 1.0
   80    44   -49    57  -0.07550 -1.0 2.0
   80    44   -49    57   0.20000  1.0 3.0
   80    44    52    53   0.15000  1.0 3.0
   80    44    52    54   0.15000  1.0 3.0
   80    44    52    55   0.15000  1.0 3.0
   80    87   -39    33   0.56750  1.0 1.0
   80    87   -39    33  -0.07550 -1.0 2.0
   80    87   -39    33   0.20000  1.0 3.0
   80    87    39    40   0.62750  1.0 1.0
   80    87    39    40  -0.30950 -1.0 2.0
   80    87    39    40   0.27300  1.0 3.0
   80    87    39    41   0.15000  1.0 3.0
   81    80    87    88   0.15000  1.0 3.0
   81    80    87    89   0.15000  1.0 3.0
   81    80    87    39   0.15000  1.0 3.0
   88    87    39    33   0.15000  1.0 3.0
   88    87    39    40   0.23400  1.0 3.0
   88    87    39    41   0.15000  1.0 3.0
   89    87    39    33   0.15000  1.0 3.0
   89    87    39    40   0.23400  1.0 3.0
   89    87    39    41   0.15000  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    42   0.56750  1.0 1.0
   39    33    37    42  -0.07550 -1.0 2.0
   39    33    37    42   0.20000  1.0 3.0
   39    33   -37    44   0.56750  1.0 1.0
   39    33   -37    44  -0.07550 -1.0 2.0
   39    33   -37    44   0.20000  1.0 3.0
   39    33    86    56   0.56750  1.0 1.0
   39    33    86    56  -0.07550 -1.0 2.0
   39    33    86    56   0.20000  1.0 3.0
   39    33    86    77   0.56750  1.0 1.0
   39    33    86    77  -0.07550 -1.0 2.0
   39    33    86    77   0.20000  1.0 3.0
   39    33    86    92   0.86500  1.0 1.0
   39    33    86    92  -0.17500 -1.0 2.0
   39    33    86    92   0.20800  1.0 3.0
   74    65    71    72   0.23400  1.0 3.0
   74    65    71    73   0.23400  1.0 3.0
   74    65    71    80   0.62750  1.0 1.0
   74    65    71    80  -0.30950 -1.0 2.0
   74    65    71    80   0.27300  1.0 3.0
   74    82    90    94  -0.09450  1.0 1.0
   74    82    90    94  -1.12950 -1.0 2.0
   74    82    90    94   0.54000  1.0 3.0
   74    82    90    96   1.11900  1.0 1.0
   74    82    90    96  -1.16350 -1.0 2.0
   74    82    90    96  -0.34150  1.0 3.0
   74    82    90    97   3.69350  1.0 1.0
   74    82    90    97  -1.82950 -1.0 2.0
   74    82   107   105  -0.53350  1.0 1.0
   74    82   107   105  -0.78350 -1.0 2.0
   74    82   107   105   0.33750  1.0 3.0
   82    90    94    95   0.30150 -1.0 2.0
   82    90    94   102   0.60050  1.0 1.0
   82    90    94   102   0.05600 -1.0 2.0
   82    90    94   102   0.26150  1.0 3.0
   82    90   -96    57   0.06250  1.0 1.0
   82    90   -96    57  -0.01100 -1.0 2.0
   82    90   -96    57   0.28050  1.0 3.0
   82    90    97    98  -0.11600  1.0 1.0
   82    90    97    98  -0.09450 -1.0 2.0
   82    90    97    98   0.21250  1.0 3.0
   83    82    90    94  -0.11250  1.0 3.0
   83    82    90    96   0.23400  1.0 3.0
   83    82    90    97   0.23400  1.0 3.0
   83    82   107   105   0.37050  1.0 3.0
   90    82   107   105   0.06250  1.0 1.0
   90    82   107   105  -0.01100 -1.0 2.0
   90    82   107   105   0.28050  1.0 3.0
   90    94   102   103   0.00000  1.0 1.0
   90    94   102   104   0.00000  1.0 1.0
   90    94  -102   105   0.60050  1.0 1.0
   90    94  -102   105   0.05600 -1.0 2.0
   90    94  -102   105   0.26150  1.0 3.0
   94    90    96    57  -1.11000  1.0 1.0
   94    90    96    57   0.50250 -1.0 2.0
   94    90    96    57   0.47450  1.0 3.0
   94    90    97    98   0.91850  1.0 1.0
   94    90    97    98   0.57950  1.0 3.0
   94   102   105   106  -0.11250  1.0 3.0
   94   102   105   107  -0.09450  1.0 1.0
   94   102   105   107  -1.12950 -1.0 2.0
   94   102   105   107   0.54000  1.0 3.0
   94   102   105   108  -0.95700  1.0 1.0
   94   102   105   108  -0.18200 -1.0 2.0
   94   102   105   108   0.29450  1.0 3.0
   95    94   102   103   0.00000  1.0 1.0
   95    94   102   104   0.00000  1.0 1.0
   95    94   102   105   0.30150 -1.0 2.0
  102   105  -107    82   0.06250  1.0 1.0
  102   105  -107    82  -0.01100 -1.0 2.0
  102   105  -107    82   0.28050  1.0 3.0
  102   105   108   109   0.15000  1.0 3.0
  102   105   108   110   0.15000  1.0 3.0
  102   105   108   111   0.15000  1.0 3.0
  103   102   105   106   0.15000  1.0 3.0
  103   102   105   107   0.23400  1.0 3.0
  103   102   105   108   0.15000  1.0 3.0
  104   102   105   106   0.15000  1.0 3.0
  104   102   105   107   0.23400  1.0 3.0
  104   102   105   108   0.15000  1.0 3.0
  106   105   107    82   0.37050  1.0 3.0
  106   105   108   109   0.15000  1.0 3.0
  106   105   108   110   0.15000  1.0 3.0
  106   105   108   111   0.15000  1.0 3.0
  107    82   -90    94  -0.09450  1.0 1.0
  107    82   -90    94  -1.12950 -1.0 2.0
  107    82   -90    94   0.54000  1.0 3.0
  107    82    90    96   1.11900  1.0 1.0
  107    82    90    96  -1.16350 -1.0 2.0
  107    82    90    96  -0.34150  1.0 3.0
  107    82    90    97   3.69350  1.0 1.0
  107    82    90    97  -1.82950 -1.0 2.0
  107   105   108   109   0.23400  1.0 3.0
  107   105   108   110   0.23400  1.0 3.0
  107   105   108   111   0.23400  1.0 3.0
  108   105   107    82   0.06250  1.0 1.0
  108   105   107    82  -0.01100 -1.0 2.0
  108   105   107    82   0.28050  1.0 3.0
   96    57    65    66   0.23400  1.0 3.0
   96    57    65    71   0.62750  1.0 1.0
   96    57    65    71  -0.30950 -1.0 2.0
   96    57    65    71   0.27300  1.0 3.0
   96    57   -65    74   1.11900  1.0 1.0
   96    57   -65    74  -1.16350 -1.0 2.0
   96    57   -65    74  -0.34150  1.0 3.0
   96    90    94    95   0.30150 -1.0 2.0
   96    90    94   102   0.55300  1.0 1.0
   96    90    94   102   1.25850 -1.0 2.0
   96    90    94   102  -0.23600  1.0 3.0
   96    90    97    98  -0.50000  1.0 1.0
   96    90    97    98  -0.73950 -1.0 2.0
   96    90    97    98   0.17150  1.0 3.0
   97    90    94    95   0.30150 -1.0 2.0
   97    90    94   102   0.55300  1.0 1.0
   97    90    94   102   1.25850 -1.0 2.0
   97    90    94   102  -0.23600  1.0 3.0
   97    90    96    57  -0.81800  1.0 1.0
   52    44    49    50   0.15000  1.0 3.0
   52    44    49    51   0.15000  1.0 3.0
   52    44    49    57   0.56750  1.0 1.0
   52    44    49    57  -0.07550 -1.0 2.0
   52    44    49    57   0.20000  1.0 3.0
   52    44    80    71   0.56750  1.0 1.0
   52    44    80    71  -0.07550 -1.0 2.0
   52    44    80    71   0.20000  1.0 3.0
   52    44    80    81   0.15000  1.0 3.0
   52    44    80    87   0.56750  1.0 1.0
   52    44    80    87  -0.07550 -1.0 2.0
   52    44    80    87   0.20000  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
   42    56    45    46  10.50000 -1.0 2.0
   59    99    67    75   1.10000 -1.0 2.0
   84    76    75    67   1.10000 -1.0 2.0
   75    91    84    85  10.50000 -1.0 2.0
   90   102    94    95  10.50000 -1.0 2.0
END
