* LIGAND DATABASE FILE (OPLS2005)
*
001     109   109    198    298     588
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02080   106.58464   -18.31594
    3     1 S   H    _H1_     3     1.02130    58.44205    83.81585
    4     1 S   H    _H2_     4     1.02074    53.68023  -119.66428
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C8_    36     1.83609    97.74164  -178.15857
   34    33 S   HC   _H4_    37     1.09877   104.00794    33.22536
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C9_    38     1.53933   110.91077   -79.98736
   39    38 S   HC   _H15    39     1.09632   109.60695   170.90167
   40    38 S   HC   _H16    40     1.09943   109.46766    56.58662
   41    33 S   CT   _C7_    59     1.55358   111.66767   147.15455
   42    41 S   HC   _H3_    60     1.09852   107.62399   -56.52985
   43    38 S   CD   _C10    41     1.51103   117.17257   -65.46604
   44    41 S   CT   _C5_    61     1.52951   112.24551  -173.54676
   45    44 S   HC   _H11    62     1.09607   108.21250   -60.00410
   46    43 S   NI   _N4_    42     1.28570   122.12959    85.51328
   47    44 S   CT   _C4_    63     1.52636   110.51634    58.59365
   48    47 S   HC   _H8_    64     1.09540   111.40458    61.50042
   49    47 S   HC   _H9_    65     1.09540   110.81392   -58.74853
   50    47 S   HC   _H10    66     1.09465   110.70648  -178.29246
   51    44 S   CT   _C6_    67     1.52611   110.50311  -178.61831
   52    51 S   HC   _H12    68     1.09503   111.43811   -61.49337
   53    51 S   HC   _H13    69     1.09504   110.73165   178.23076
   54    51 S   HC   _H14    70     1.09532   110.79564    58.76051
   55    43 S   OH   _O38   108     1.35416   111.24189   -95.11478
   56    55 S   HO   _H41   109     0.97144   111.29519     0.02798
   57    46 S   CT   _C11    43     1.46280   121.50149   176.26498
   58    57 S   HC   _H17    44     1.09453   113.59782   -23.46655
   59    57 S   HC   _H18    45     1.09759   107.15898  -138.97197
   60    57 S   CT   _C12    46     1.53056   111.18395   103.04196
   61    60 S   HC   _H19    47     1.09671   109.16862   174.75092
   62    60 S   HC   _H20    48     1.09652   109.46000    58.04005
   63    60 S   CM   _C13    49     1.49955   111.71368   -65.16580
   64    63 S   HC   _H21    50     1.08702   116.85608   -56.62520
   65    63 S   CM   _C14    51     1.34155   123.43560   118.21367
   66    65 S   HC   _H22    52     1.08771   119.28782     4.02146
   67    65 S   CT1  _C15    53     1.49798   122.55766  -168.88375
   68    67 S   HC   _H5_    54     1.09485   113.30860   -10.21594
   69    67 S   C    _C16    55     1.52369   106.40947   110.66471
   70    69 S   O    _O33    56     1.22949   123.09284   102.90982
   71    67 S   N    _N6_    71     1.43585   109.39205  -130.38219
   72    71 S   H    _H24    72     1.01970   118.02326   -24.82351
   73    69 S   N    _N5_    57     1.39204   111.70320   -73.55548
   74    73 S   H    _H23    58     1.01577   118.02486   -10.64814
   75    71 S   C    _C17    73     1.39201   123.35157   153.53980
   76    75 S   O    _O34    74     1.22933   124.54735    -0.03956
   77    75 S   CT1  _C18    75     1.52744   112.51414  -178.18059
   78    77 S   HC   _H6_    76     1.09792   107.60725   -31.81203
   79    77 S   CTF  _C19    77     1.54320   112.21351    88.85283
   80    79 S   HC   _H25    78     1.09855   108.37077   -59.92769
   81    77 S   N    _N7_    87     1.44093   108.02959  -145.71802
   82    81 S   H    _H32    88     1.01644   118.37350   -94.94769
   83    79 S   CT   _C20    79     1.53256   113.14025    58.60672
   84    83 S   HC   _H26    80     1.09442   111.23550    60.66228
   85    83 S   HC   _H27    81     1.09477   111.83343  -178.21195
   86    83 S   HC   _H28    82     1.09573   110.46709   -58.40259
   87    79 S   CT   _C21    83     1.53158   111.10008  -177.31503
   88    87 S   HC   _H29    84     1.09504   110.76622   -61.86242
   89    87 S   HC   _H30    85     1.09485   110.63911    57.41079
   90    87 S   HC   _H31    86     1.09454   111.66209   177.51305
   91    81 S   C    _C22    89     1.39516   123.26837    85.02653
   92    91 S   O    _O35    90     1.22961   124.32035     0.08847
   93    91 S   N    _N8_    91     1.39250   111.33111  -179.97202
   94    93 S   H    _H33    92     1.01523   118.81982    -3.03570
   95    93 S   CT1  _C23    93     1.44455   122.79510  -179.93147
   96    95 S   HC   _H7_    94     1.09920   105.34977    -0.08393
   97    95 S   CO3  _C27    95     1.54585   111.83842  -112.89390
   98    97 S   O2Z  _O37    96     1.26226   116.14682    24.97364
   99    97 S   O2Z  _O36    97     1.26474   115.03345  -156.51733
  100    95 S   CTF  _C24    98     1.54476   110.70015   116.69218
  101   100 S   HC   _H34    99     1.09815   108.48967  -171.52497
  102   100 S   CT   _C25   100     1.53364   112.79073   -52.67034
  103   102 S   HC   _H35   101     1.09537   110.37998    60.46910
  104   102 S   HC   _H36   102     1.09513   111.66242   -59.05245
  105   102 S   HC   _H37   103     1.09336   111.49937   179.92338
  106   100 S   CT   _C26   104     1.53320   111.52556    71.28750
  107   106 S   HC   _H38   105     1.09571   110.51400   -61.72475
  108   106 S   HC   _H39   106     1.09458   110.80770   178.99400
  109   106 S   HC   _H40   107     1.09486   111.75429    58.19218
  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  10   5   4   3
  16   8   2   1   1  11   5   4  17   7   7  12   9   9   8   3
   2   1   4   2   1   1   2   1   8   5   4   7   4   3   7   3
   9   4  10   6   6   3   8   3   1   1  10   4  16   7  12   9
   8   3   7   3   2   1   3   2   1   1   7   3  10   4  14   7
   6   2   1   9   8   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    73    41    42    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    46    69    73    74    41    42    44    45    47    51    55  
   38    39    40    43    73    41    42    44  
   36    37  
   37  
    0  
   39    40    43    46    57    73    41    42    44    55    56  
   40    43    46    41    55  
   43    46    41    55  
   42    44    45    47    48    49    50    51    52    53    54    43    67    69    70    73    74  
   44    45    47    51    69    73    74  
   46    57    58    59    60    55    56  
   45    47    48    49    50    51    52    53    54    69    73    74  
   47    48    49    50    51    52    53    54    73  
   57    58    59    60    61    62    63    55    56  
   48    49    50    51    52    53    54    73  
   49    50    51  
   50    51  
   51  
   52    53    54    73  
   53    54  
   54  
    0  
   56    57  
    0  
   58    59    60    61    62    63    64    65  
   59    60    61    62    63  
   60    61    62    63  
   61    62    63    64    65    66    67  
   62    63    64    65  
   63    64    65  
   64    65    66    67    68    69    71  
   65    66    67  
   66    67    68    69    70    73    71    72    75  
   67    68    69    71  
   68    69    70    73    74    71    72    75    76    77  
   69    70    73    71    72    75  
   70    73    74    71    72    75  
   73    74    71  
   72    75    76    77    78    79    81    73  
   75    76    77  
   74  
    0  
   76    77    78    79    80    83    87    81    82    91  
   77    78    79    81  
   78    79    80    83    84    85    86    87    88    89    90    81    82    91    92    93  
   79    80    83    87    81    82    91  
   80    83    84    85    86    87    88    89    90    81    82    91  
   83    84    85    86    87    88    89    90    81  
   82    91    92    93    94    95    83    87  
   91    92    93  
   84    85    86    87    88    89    90  
   85    86    87  
   86    87  
   87  
   88    89    90  
   89    90  
   90  
    0  
   92    93    94    95    96    97   100  
   93    94    95  
   94    95    96    97    98    99   100   101   102   106  
   95    96    97   100  
   96    97    98    99   100   101   102   103   104   105   106   107   108   109  
   97    98    99   100   101   102   106  
   98    99   100   101   102   106  
   99   100  
  100  
  101   102   103   104   105   106   107   108   109  
  102   103   104   105   106   107   108   109  
  103   104   105   106   107   108   109  
  104   105   106  
  105   106  
  106  
  107   108   109  
  108   109  
  109  
    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   3.5000   0.0660  -0.083900   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.7500   0.1050   0.438600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.2800   0.1700  -0.609900   1.8540   1.6400   0.005000000   0.000000000
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.503000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5000   0.0660   0.100200   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   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   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   71   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   72   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   73   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   74   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   75   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   77   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   79   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.2500   0.1700  -0.488600   1.8100   1.6000   0.054801302  -1.445846770
   82   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   83   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.7500   0.1050   0.766100   1.9250   1.7000   0.001000000  -0.126889456
   92   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   93   3.2500   0.1700  -0.488600   1.8100   1.6000   0.054801302  -1.445846770
   94   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   95   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  100   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   270.000  1.508
   43    46   500.000  1.261
   43    55   440.000  1.374
   46    57   315.000  1.435
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   317.000  1.510
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   340.000  1.080
   65    67   317.000  1.510
   67    68   340.000  1.090
   67    69   317.000  1.522
   67    71   337.000  1.449
   69    70   570.000  1.229
   69    73   490.000  1.335
   73    74   434.000  1.010
   73    41   337.000  1.449
   41    42   340.000  1.090
   41    44   268.000  1.529
   44    45   340.000  1.090
   44    47   268.000  1.529
   44    51   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   71    72   434.000  1.010
   71    75   490.000  1.335
   75    76   570.000  1.229
   75    77   317.000  1.522
   77    78   340.000  1.090
   77    79   268.000  1.529
   77    81   337.000  1.449
   79    80   340.000  1.090
   79    83   268.000  1.529
   79    87   268.000  1.529
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   340.000  1.090
   81    82   434.000  1.010
   81    91   490.000  1.335
   91    92   570.000  1.229
   91    93   490.000  1.335
   93    94   434.000  1.010
   93    95   337.000  1.449
   95    96   340.000  1.090
   95    97   317.000  1.522
   95   100   268.000  1.529
   97    98   656.000  1.250
   97    99   656.000  1.250
  100   101   340.000  1.090
  100   102   268.000  1.529
  100   106   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   55    56   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    70.00000  111.76100
   33    41    73    70.00000  110.72300
   33    41    42    37.50000  110.70000
   33    41    44    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    46    65.00000  122.10100
   38    43    55    85.00000  110.80600
   40    38    39    33.00000  107.80000
   43    38    39    45.00000  109.49600
   43    38    40    45.00000  109.49600
   43    46    57    70.00000  113.48600
   43    55    56    70.00000  105.55000
   46    57    58    50.00000  110.29200
   46    57    59    50.00000  110.29200
   46    57    60    80.00000  110.18800
   57    60    61    37.50000  110.70000
   57    60    62    37.50000  110.70000
   57    60    63    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    63    64    35.00000  117.00000
   60    63    65    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    35.00000  109.50000
   63    60    62    35.00000  109.50000
   63    65    66    35.00000  120.00000
   63    65    67    70.00000  124.00000
   65    63    64    35.00000  120.00000
   65    67    68    35.00000  109.50000
   65    67    69    70.00000  115.00700
   65    67    71    75.00000  110.78400
   67    65    66    35.00000  117.00000
   67    69    70    80.00000  120.40000
   67    69    73    70.00000  116.60000
   67    71    72    38.00000  118.40000
   67    71    75    50.00000  121.90000
   69    67    68    35.00000  109.50000
   69    73    74    35.00000  119.80000
   69    73    41    50.00000  121.90000
   73    69    70    80.00000  122.90000
   73    41    42    35.00000  109.50000
   73    41    44    70.00000  110.72300
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    73    74    38.00000  118.40000
   41    44    45    37.50000  110.70000
   41    44    47    58.35000  112.70000
   41    44    51    58.35000  112.70000
   44    41    42    37.50000  110.70000
   44    47    48    37.50000  110.70000
   44    47    49    37.50000  110.70000
   44    47    50    37.50000  110.70000
   44    51    52    37.50000  110.70000
   44    51    53    37.50000  110.70000
   44    51    54    37.50000  110.70000
   47    44    45    37.50000  110.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   51    44    45    37.50000  110.70000
   51    44    47    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   71    67    68    35.00000  109.50000
   71    67    69    63.00000  110.10000
   71    75    76    80.00000  122.90000
   71    75    77    70.00000  116.60000
   75    71    72    35.00000  119.80000
   75    77    78    35.00000  109.50000
   75    77    79    63.00000  111.10000
   75    77    81    63.00000  110.10000
   77    75    76    80.00000  120.40000
   77    79    80    37.50000  110.70000
   77    79    83    58.35000  112.70000
   77    79    87    58.35000  112.70000
   77    81    82    38.00000  118.40000
   77    81    91    50.00000  121.90000
   79    77    78    37.50000  110.70000
   79    83    84    37.50000  110.70000
   79    83    85    37.50000  110.70000
   79    83    86    37.50000  110.70000
   79    87    88    37.50000  110.70000
   79    87    89    37.50000  110.70000
   79    87    90    37.50000  110.70000
   83    79    80    37.50000  110.70000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   87    79    80    37.50000  110.70000
   87    79    83    58.35000  112.70000
   89    87    88    33.00000  107.80000
   90    87    88    33.00000  107.80000
   90    87    89    33.00000  107.80000
   81    77    78    35.00000  109.50000
   81    77    79    80.00000  109.70000
   81    91    92    80.00000  122.90000
   81    91    93    90.00000  111.91700
   91    81    82    35.00000  119.80000
   91    93    94    35.00000  119.80000
   91    93    95    50.00000  121.90000
   93    91    92    80.00000  122.90000
   93    95    96    35.00000  109.50000
   93    95    97    63.00000  110.10000
   93    95   100    80.00000  109.70000
   95    93    94    38.00000  118.40000
   95    97    98    70.00000  117.00000
   95    97    99    70.00000  117.00000
   95   100   101    37.50000  110.70000
   95   100   102    58.35000  112.70000
   95   100   106    58.35000  112.70000
   97    95    96    35.00000  109.50000
   99    97    98    80.00000  126.00000
  100    95    96    37.50000  110.70000
  100    95    97    63.00000  111.10000
  100   102   103    37.50000  110.70000
  100   102   104    37.50000  110.70000
  100   102   105    37.50000  110.70000
  100   106   107    37.50000  110.70000
  100   106   108    37.50000  110.70000
  100   106   109    37.50000  110.70000
  102   100   101    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
  106   100   101    37.50000  110.70000
  106   100   102    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   55    43    46    90.00000  118.59000
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    41    73   0.56750  1.0 1.0
   29    33    41    73  -0.07550 -1.0 2.0
   29    33    41    73   0.20000  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    44   0.44750  1.0 1.0
   29    33    41    44  -0.17800 -1.0 2.0
   29    33    41    44   0.20200  1.0 3.0
   33    38    43    46   0.00000  1.0 1.0
   33    38    43    55   0.00000  1.0 1.0
   33    41    44    45   0.15000  1.0 3.0
   33    41    44    47   0.56750  1.0 1.0
   33    41    44    47  -0.07550 -1.0 2.0
   33    41    44    47   0.20000  1.0 3.0
   33    41    44    51   0.56750  1.0 1.0
   33    41    44    51  -0.07550 -1.0 2.0
   33    41    44    51   0.20000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43   0.15000  1.0 3.0
   34    33    41    73   0.15000  1.0 3.0
   34    33    41    42   0.15000  1.0 3.0
   34    33    41    44   0.15000  1.0 3.0
   38    33    41    73   0.43900  1.0 1.0
   38    33    41    73   0.49100 -1.0 2.0
   38    33    41    73   0.28400  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    44   0.56750  1.0 1.0
   38    33    41    44  -0.07550 -1.0 2.0
   38    33    41    44   0.20000  1.0 3.0
   38    43    46    57   6.00000 -1.0 2.0
   38    43    55    56   1.50000 -1.0 2.0
   39    38    43    46   0.00000  1.0 1.0
   39    38    43    55   0.00000  1.0 1.0
   40    38    43    46   0.00000  1.0 1.0
   40    38    43    55   0.00000  1.0 1.0
   43    46    57    58  -0.15000  1.0 3.0
   43    46    57    59  -0.15000  1.0 3.0
   43    46    57    60  -0.12500  1.0 1.0
   43    46    57    60  -0.12500 -1.0 2.0
   43    46    57    60   0.25000  1.0 3.0
   46    43    55    56   1.50000 -1.0 2.0
   46    57    60    61   0.15000  1.0 3.0
   46    57    60    62   0.15000  1.0 3.0
   46    57    60    63   0.56750  1.0 1.0
   46    57    60    63  -0.07550 -1.0 2.0
   46    57    60    63   0.20000  1.0 3.0
   57    60    63    64   0.00000  1.0 1.0
   57    60    63    65   0.09850  1.0 1.0
   57    60    63    65   0.15250 -1.0 2.0
   57    60    63    65  -0.50650  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   58    57    60    63   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   59    57    60    63   0.15000  1.0 3.0
   60    63    65    66   7.00000 -1.0 2.0
   60    63    65    67   7.00000 -1.0 2.0
   61    60    63    64   0.33100  1.0 3.0
   61    60    63    65   0.00000  1.0 1.0
   62    60    63    64   0.33100  1.0 3.0
   62    60    63    65   0.00000  1.0 1.0
   63    65    67    68   0.00000  1.0 1.0
   63    65    67    69  -0.51250  1.0 1.0
   63    65    67    69  -0.88800 -1.0 2.0
   63    65    67    69   0.08850  1.0 3.0
   63    65    67    71   0.62150  1.0 1.0
   63    65    67    71   0.42850 -1.0 2.0
   63    65    67    71  -0.68200  1.0 3.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    67   7.00000 -1.0 2.0
   65    67    69    70   0.30150 -1.0 2.0
   65    67    69    73   0.00000  1.0 1.0
   65    67    71    72   0.00000  1.0 1.0
   65    67    71    75  -0.19250  1.0 1.0
   65    67    71    75  -0.00500 -1.0 2.0
   65    67    71    75   0.17000  1.0 3.0
   66    65    67    68   0.33100  1.0 3.0
   66    65    67    69   0.00000  1.0 1.0
   66    65    67    71   0.00000  1.0 1.0
   67    69    73    74   2.45000 -1.0 2.0
   67    69    73    41   1.15000  1.0 1.0
   67    69    73    41   3.04450 -1.0 2.0
   67    71    75    76   3.04450 -1.0 2.0
   67    71    75    77   1.15000  1.0 1.0
   67    71    75    77   3.04450 -1.0 2.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    69    73   0.00000  1.0 1.0
   68    67    71    72   0.00000  1.0 1.0
   68    67    71    75   0.00000  1.0 1.0
   69    67    71    72   0.00000  1.0 1.0
   69    67    71    75  -0.29800  1.0 1.0
   69    67    71    75   0.13950 -1.0 2.0
   69    67    71    75  -2.45650  1.0 3.0
   69    73    41    33  -0.43950  1.0 1.0
   69    73    41    33  -0.08100 -1.0 2.0
   69    73    41    33   0.03350  1.0 3.0
   69    73    41    42   0.00000  1.0 1.0
   69    73    41    44  -0.43950  1.0 1.0
   69    73    41    44  -0.08100 -1.0 2.0
   69    73    41    44   0.03350  1.0 3.0
   70    69    73    74   2.45000 -1.0 2.0
   70    69    73    41   3.04450 -1.0 2.0
   73    41    44    45   0.15000  1.0 3.0
   73    41    44    47   0.43900  1.0 1.0
   73    41    44    47   0.49100 -1.0 2.0
   73    41    44    47   0.28400  1.0 3.0
   73    41    44    51   0.43900  1.0 1.0
   73    41    44    51   0.49100 -1.0 2.0
   73    41    44    51   0.28400  1.0 3.0
   74    73    41    33   0.00000  1.0 1.0
   74    73    41    42   0.00000  1.0 1.0
   74    73    41    44   0.00000  1.0 1.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43   0.34400  1.0 1.0
   41    33    38    43   0.09450 -1.0 2.0
   41    33    38    43   0.11100  1.0 3.0
   41    44    47    48   0.15000  1.0 3.0
   41    44    47    49   0.15000  1.0 3.0
   41    44    47    50   0.15000  1.0 3.0
   41    44    51    52   0.15000  1.0 3.0
   41    44    51    53   0.15000  1.0 3.0
   41    44    51    54   0.15000  1.0 3.0
   42    41    44    45   0.15000  1.0 3.0
   42    41    44    47   0.15000  1.0 3.0
   42    41    44    51   0.15000  1.0 3.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    49   0.15000  1.0 3.0
   45    44    47    50   0.15000  1.0 3.0
   45    44    51    52   0.15000  1.0 3.0
   45    44    51    53   0.15000  1.0 3.0
   45    44    51    54   0.15000  1.0 3.0
   47    44    51    52   0.15000  1.0 3.0
   47    44    51    53   0.15000  1.0 3.0
   47    44    51    54   0.15000  1.0 3.0
   51    44    47    48   0.15000  1.0 3.0
   51    44    47    49   0.15000  1.0 3.0
   51    44    47    50   0.15000  1.0 3.0
   71    67    69    70   0.00000  1.0 1.0
   71    67    69    73   0.37150  1.0 1.0
   71    67    69    73   1.25400 -1.0 2.0
   71    67    69    73  -0.40250  1.0 3.0
   71    75    77    78   0.00000  1.0 1.0
   71    75    77    79   0.93250  1.0 1.0
   71    75    77    79   0.04450 -1.0 2.0
   71    75    77    79   0.17550  1.0 3.0
   71    75    77    81   0.37150  1.0 1.0
   71    75    77    81   1.25400 -1.0 2.0
   71    75    77    81  -0.40250  1.0 3.0
   72    71    75    76   2.45000 -1.0 2.0
   72    71    75    77   2.45000 -1.0 2.0
   75    77    79    80  -0.03800  1.0 3.0
   75    77    79    83  -0.45800  1.0 1.0
   75    77    79    83   0.20550 -1.0 2.0
   75    77    79    87  -0.45800  1.0 1.0
   75    77    79    87   0.20550 -1.0 2.0
   75    77    81    82   0.00000  1.0 1.0
   75    77    81    91  -0.29800  1.0 1.0
   75    77    81    91   0.13950 -1.0 2.0
   75    77    81    91  -2.45650  1.0 3.0
   76    75    77    78   0.00000  1.0 1.0
   76    75    77    79   0.00000  1.0 1.0
   76    75    77    81   0.00000  1.0 1.0
   77    79    83    84   0.15000  1.0 3.0
   77    79    83    85   0.15000  1.0 3.0
   77    79    83    86   0.15000  1.0 3.0
   77    79    87    88   0.15000  1.0 3.0
   77    79    87    89   0.15000  1.0 3.0
   77    79    87    90   0.15000  1.0 3.0
   77    81    91    92   3.04450 -1.0 2.0
   77    81    91    93   4.56800  1.0 1.0
   77    81    91    93   0.31650 -1.0 2.0
   78    77    79    80   0.15000  1.0 3.0
   78    77    79    83   0.15000  1.0 3.0
   78    77    79    87   0.15000  1.0 3.0
   78    77    81    82   0.00000  1.0 1.0
   78    77    81    91   0.00000  1.0 1.0
   79    77    81    82   0.00000  1.0 1.0
   79    77    81    91   0.25950  1.0 1.0
   79    77    81    91   0.43850 -1.0 2.0
   79    77    81    91   2.61650  1.0 3.0
   80    79    83    84   0.15000  1.0 3.0
   80    79    83    85   0.15000  1.0 3.0
   80    79    83    86   0.15000  1.0 3.0
   80    79    87    88   0.15000  1.0 3.0
   80    79    87    89   0.15000  1.0 3.0
   80    79    87    90   0.15000  1.0 3.0
   83    79    87    88   0.15000  1.0 3.0
   83    79    87    89   0.15000  1.0 3.0
   83    79    87    90   0.15000  1.0 3.0
   87    79    83    84   0.15000  1.0 3.0
   87    79    83    85   0.15000  1.0 3.0
   87    79    83    86   0.15000  1.0 3.0
   81    77    79    80   0.23200  1.0 3.0
   81    77    79    83   0.26400  1.0 1.0
   81    77    79    83   0.16150 -1.0 2.0
   81    77    79    83   0.25850  1.0 3.0
   81    77    79    87   0.26400  1.0 1.0
   81    77    79    87   0.16150 -1.0 2.0
   81    77    79    87   0.25850  1.0 3.0
   81    91    93    94   2.56700 -1.0 2.0
   81    91    93    95   4.56800  1.0 1.0
   81    91    93    95   0.31650 -1.0 2.0
   82    81    91    92   2.45000 -1.0 2.0
   82    81    91    93   2.56700 -1.0 2.0
   91    93    95    96   0.00000  1.0 1.0
   91    93    95    97  -0.29800  1.0 1.0
   91    93    95    97   0.13950 -1.0 2.0
   91    93    95    97  -2.45650  1.0 3.0
   91    93    95   100   0.25950  1.0 1.0
   91    93    95   100   0.43850 -1.0 2.0
   91    93    95   100   2.61650  1.0 3.0
   92    91    93    94   2.45000 -1.0 2.0
   92    91    93    95   3.04450 -1.0 2.0
   93    95    97    98   0.00000  1.0 1.0
   93    95    97    99   0.00000  1.0 1.0
   93    95   100   101   0.23200  1.0 3.0
   93    95   100   102   0.26400  1.0 1.0
   93    95   100   102   0.16150 -1.0 2.0
   93    95   100   102   0.25850  1.0 3.0
   93    95   100   106   0.26400  1.0 1.0
   93    95   100   106   0.16150 -1.0 2.0
   93    95   100   106   0.25850  1.0 3.0
   94    93    95    96   0.00000  1.0 1.0
   94    93    95    97   0.00000  1.0 1.0
   94    93    95   100   0.00000  1.0 1.0
   95   100   102   103   0.15000  1.0 3.0
   95   100   102   104   0.15000  1.0 3.0
   95   100   102   105   0.15000  1.0 3.0
   95   100   106   107   0.15000  1.0 3.0
   95   100   106   108   0.15000  1.0 3.0
   95   100   106   109   0.15000  1.0 3.0
   96    95    97    98   0.00000  1.0 1.0
   96    95    97    99   0.00000  1.0 1.0
   96    95   100   101   0.15000  1.0 3.0
   96    95   100   102   0.15000  1.0 3.0
   96    95   100   106   0.15000  1.0 3.0
   97    95   100   101  -0.03800  1.0 3.0
   97    95   100   102  -0.45800  1.0 1.0
   97    95   100   102   0.20550 -1.0 2.0
   97    95   100   106  -0.45800  1.0 1.0
   97    95   100   106   0.20550 -1.0 2.0
  100    95    97    98   0.00000  1.0 1.0
  100    95    97    99   0.00000  1.0 1.0
  101   100   102   103   0.15000  1.0 3.0
  101   100   102   104   0.15000  1.0 3.0
  101   100   102   105   0.15000  1.0 3.0
  101   100   106   107   0.15000  1.0 3.0
  101   100   106   108   0.15000  1.0 3.0
  101   100   106   109   0.15000  1.0 3.0
  102   100   106   107   0.15000  1.0 3.0
  102   100   106   108   0.15000  1.0 3.0
  102   100   106   109   0.15000  1.0 3.0
  106   100   102   103   0.15000  1.0 3.0
  106   100   102   104   0.15000  1.0 3.0
  106   100   102   105   0.15000  1.0 3.0
   55    43    46    57   6.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    55    43    46  10.50000 -1.0 2.0
   60    64    63    65   1.10000 -1.0 2.0
   67    66    65    63   1.10000 -1.0 2.0
   67    73    69    70  10.50000 -1.0 2.0
   74    69    73    41   1.00000 -1.0 2.0
   72    75    71    67   1.00000 -1.0 2.0
   71    77    75    76  10.50000 -1.0 2.0
   82    91    81    77   1.00000 -1.0 2.0
   81    93    91    92  10.50000 -1.0 2.0
   94    91    93    95   1.00000 -1.0 2.0
   98    95    97    99  10.50000 -1.0 2.0
END
