* LIGAND DATABASE FILE (OPLS2005)
*
001     102   105    195    314     586
    1     0 S   NP   _N1_     1    29.14712    91.78013   -20.21452
    2     1 S   H    _HN1     2     1.02830    19.74261   128.21416
    3     1 S   H    _H1_     3     1.02777    88.54061   -62.83073
    4     1 S   H    _H2_     4     1.02933   111.02213    46.22717
    5     1 S   CT   _CA1     5     1.50167   123.81460  -178.80237
    6     5 S   HC   _HA1     6     1.09575   105.24797    43.04202
    7     5 S   CO3  _C1_     7     1.53795   112.30298   -77.08485
    8     7 S   O2Z  _O11     8     1.26335   115.05905   -45.23229
    9     7 S   O2Z  _O12     9     1.26236   114.92765   133.86047
   10     5 S   CT   _CB1    10     1.53068   107.31146   160.81432
   11    10 S   HC   HB11    11     1.09814   109.20588   -51.40097
   12    10 S   HC   HB12    12     1.09860   110.38165    64.96604
   13    10 S   CT   _CG1    13     1.53131   112.87959  -172.73769
   14    13 S   HC   HG11    14     1.09565   110.09458   -61.07045
   15    13 S   HC   HG12    15     1.09593   110.44177    58.14030
   16    13 S   C    _CD1    16     1.51820   111.55807   177.91343
   17    16 S   O    _OE1    17     1.22823   122.80098   -24.59328
   18    16 S   N    _N2_    18     1.38634   112.25957   156.08803
   19    18 S   H    _HN2    19     1.01580   119.23641     2.33917
   20    18 S   CT1  _CA2    20     1.46334   123.06380  -175.32655
   21    20 S   HC   _HA2    21     1.09738   109.21382   -17.66103
   22    20 S   C    _C2_    22     1.53188   107.64524  -133.53083
   23    22 S   O    _O2_    23     1.22955   122.63731  -140.49403
   24    20 S   CT   _CB2    32     1.53882   112.08390   104.12007
   25    24 S   HC   HB21    33     1.09480   109.27828    62.19378
   26    24 S   HC   HB22    34     1.09364   109.45289  -179.08743
   27    22 S   N    _N3_    24     1.38459   113.14418    46.11202
   28    27 S   H    _HN3    25     1.01664   119.53669    -3.47936
   29    24 S   S    _SG2    35     1.82760   111.27064   -57.48225
   30    27 S   CT   _CA3    26     1.45293   122.91048   177.06022
   31    30 S   HC   HA31    27     1.09558   107.52915   -63.19712
   32    30 S   HC   HA32    28     1.09564   107.90134    53.14938
   33    29 S   CT   _C15    36     1.85006   103.87773  -164.82260
   34    30 S   CO3  _C3_    29     1.52907   114.27075   175.15059
   35    34 S   O2Z  _O31    30     1.26349   116.09455    -0.14537
   36    34 S   O2Z  _O32    31     1.26445   114.41125   179.92867
   37    33 S   CO4  _C14    37     1.52231   106.96541   -56.79596
   38    37 S   O    _O35    38     1.22333   126.39862    73.10474
   39    33 S   CT   _C16    61     1.55764   113.74201    62.59947
   40    39 S   HC   _H23    62     1.09625   106.40116   -79.71368
   41    39 S   HC   _H24    63     1.09894   109.46822   168.88701
   42    37 S   OS   _O34    39     1.35460   110.99692  -106.60436
   43    42 S   CO4  _C13    40     1.35389   111.83646    -8.02669
   44    43 S   O    _O33    41     1.22115   123.03005  -178.27921
   45    33 S   CT   _C12    42     1.55593   114.81408  -168.07769
   46    45 S   HC   _H5_    43     1.09816   106.48711  -151.84244
   47    45 S   CT   _C11    44     1.57372   119.04489   -28.79223
   48    47 S   HC   _H4_    45     1.08806   107.54103   -13.24380
   49    47 S   CT   _C21    46     1.58818   112.05862  -127.55822
   50    49 S   OM   _O36    47     1.32510   106.30717   -63.34734
   51    49 S   HC   _H7_    48     1.09927   105.33745   169.79529
   52    47 S   CT   _C10    80     1.57479   115.74800   101.37844
   53    52 S   HC   _H3_    81     1.09535   110.45819    75.88574
   54    49 S   CM   _C20    49     1.53378   116.88408    57.27286
   55    52 S   CT   _C9_    82     1.54219   112.31534  -162.09195
   56    55 S   HC   _H21    83     1.09756   109.12821    58.48133
   57    55 S   HC   _H22    84     1.09432   110.30577   -59.42866
   58    52 S   OH   _O43   101     1.42834   109.46087   -42.19407
   59    58 S   HO   _H32   102     0.97227   107.68550   160.53898
   60    54 S   CM   _C19    50     1.34530   133.33535    21.21067
   61    55 S   CT   _C8_    85     1.53400   113.15472   178.97435
   62    61 S   HC   _H19    86     1.09535   110.16919   -59.58089
   63    61 S   HC   _H20    87     1.09648   109.51015    58.28256
   64    60 S   CO4  _C23    51     1.47223   107.67673   174.26195
   65    64 S   O    _O39    52     1.21774   126.81120  -177.00383
   66    60 S   CT   _C18    56     1.50195   132.62133     5.84150
   67    66 S   HC   _H25    57     1.08775   110.25001    17.64235
   68    66 S   HC   _H26    58     1.09955   106.74246   126.40114
   69    61 S   CT   _C7_    88     1.53040   111.20503   179.79347
   70    69 S   HC   _H17    89     1.09695   109.40941    58.76158
   71    69 S   HC   _H18    90     1.09670   109.71031   -58.55059
   72    64 S   OS   _O38    53     1.34455   108.04524     1.11698
   73    66 S   CT   _C17    59     1.55575   120.62739  -110.40741
   74    73 S   HC   _H6_    60     1.09894   104.14258   177.55271
   75    69 S   CT   _C6_    91     1.52942   111.32791  -179.97202
   76    75 S   HC   _H15    92     1.09634   109.68521   -56.58995
   77    75 S   HC   _H16    93     1.09681   109.55394    60.63077
   78    54 S   CO4  _C22    54     1.48915   120.18410  -166.51296
   79    78 S   O    _O37    55     1.21831   127.85098     0.69380
   80    73 S   CT   _C24    64     1.56489   112.66683   -68.64152
   81    80 S   HC   _H8_    65     1.09632   109.75051    66.14847
   82    75 S   CT   _C5_    94     1.52821   111.31381  -177.92935
   83    82 S   HC   _H13    95     1.09617   109.86046   -59.59177
   84    82 S   HC   _H14    96     1.09625   109.88648    58.15346
   85    80 S   CT   _C25    66     1.54660   115.26907  -172.35671
   86    85 S   HC   _H9_    67     1.09698   109.20874   -63.26571
   87    80 S   OH   _O42    78     1.43174   108.96738   -51.96977
   88    87 S   HO   _H31    79     0.97384   107.38662    84.72534
   89    82 S   CT   _C4_    97     1.52023   111.46437   179.20944
   90    89 S   HC   _H10    98     1.09475   110.97628   -60.35489
   91    89 S   HC   _H11    99     1.09466   111.00865    60.16580
   92    89 S   HC   _H12   100     1.09447   110.26317   179.93439
   93    85 S   CT   _C26    68     1.53010   112.36667   176.09079
   94    93 S   HC   _H27    69     1.09551   109.64936    66.49811
   95    93 S   HC   _H28    70     1.09558   112.39885   -53.56399
   96    93 S   CM   _C27    71     1.49194   108.79019  -173.11755
   97    96 S   HC   _H29    72     1.08541   118.61751  -152.33006
   98    96 S   CM   _C28    73     1.33661   121.40237    28.17486
   99    98 S   HC   _H30    74     1.08353   121.48251   178.83534
  100    98 S   CO4  _C29    75     1.47435   120.58556     3.76359
  101   100 S   O    _O40    76     1.22540   120.66903   166.04934
  102    85 S   OS   _O41    77     1.44724   109.10615    53.81270
  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  12   5   4   3
  18   2   1   1  11   4  17   6   5   5   7   3  12   4  15   8
  13   5   4  11   6  10  11   6   5   2   1  11   9   5   4   8
   3  10   4   3   9   5   4   2   9   4   9   5   4   1   1  11
   6   6   5   4  12   7   3   1   3   2   1   1   8   5   4   6
   3   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    45    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    43    45    46    47    73    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    45    46    47    48    49    66    73    74    39    40    41    80    52  
   35    36  
   36  
    0  
   38    42    43    44    45    46    47    73    39    40    41  
   42    43    45    39  
   40    41    80    81    85    87    42    43    45    46    47    60    66    67    68    73    74  
   41    80    45    66    73    74  
   80    45    66    73    74  
   43    44    45    46    47  
   44    45    46    47    48    49    52  
   45    46    47  
   46    47    48    49    50    51    54    73    52    53    55    58  
   47    48    49    52  
   48    49    50    51    54    60    78    52    53    55    56    57    61    58    59  
   49    50    51    54    52    53    55    58  
   50    51    54    60    64    72    78    79    66    52    53    55    58  
   51    54    60    78    52  
   54    60    78    52  
   53    55    56    57    61    62    63    69    58    59    54  
   55    56    57    61    58    59  
   60    64    65    72    78    79    66    67    68    73  
   56    57    61    62    63    69    70    71    75    58    59  
   57    61    62    63    69    58  
   61    62    63    69    58  
   59    61  
    0  
   64    65    72    78    79    66    67    68    73    74    80  
   62    63    69    70    71    75    76    77    82  
   63    69    70    71    75  
   69    70    71    75  
   65    72    78    79    66    67    68    73  
   72    78    66  
   67    68    73    74    80    81    85    87    72    78  
   68    73    74    80  
   73    74    80  
   70    71    75    76    77    82    83    84    89  
   71    75    76    77    82  
   75    76    77    82  
   78    79  
   74    80    81    85    86    93   102    87    88  
   80    81    85    87  
   76    77    82    83    84    89    90    91    92  
   77    82    83    84    89  
   82    83    84    89  
   79  
    0  
   81    85    86    93    94    95    96   100   102    87    88  
   85    86    93   102    87    88  
   83    84    89    90    91    92  
   84    89    90    91    92  
   89    90    91    92  
   86    93    94    95    96    97    98   100   101   102    87    88  
   93    94    95    96   100   102    87  
   88    93   102  
    0  
   90    91    92  
   91    92  
   92  
    0  
   94    95    96    97    98    99   100   102  
   95    96    97    98   102  
   96    97    98   102  
   97    98    99   100   101   102  
   98    99   100  
   99   100   101   102  
  100   101   102  
  101   102  
  102  
    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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   51   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5000   0.0660  -0.120000   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   80   3.5000   0.0660   0.205000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   97   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    45   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   214.000  1.327
   42    43   214.000  1.327
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   268.000  1.529
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    52   268.000  1.529
   49    50   570.000  1.307
   49    51   340.000  1.090
   49    54   317.000  1.510
   54    60   549.000  1.340
   54    78   320.000  1.462
   60    64   320.000  1.462
   60    66   317.000  1.510
   64    65   570.000  1.229
   64    72   214.000  1.327
   72    78   214.000  1.327
   78    79   570.000  1.229
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   268.000  1.529
   73    74   340.000  1.090
   73    39   268.000  1.529
   73    80   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   80    81   340.000  1.090
   80    85   268.000  1.529
   80    87   320.000  1.410
   85    86   340.000  1.090
   85    93   268.000  1.529
   85   102   320.000  1.410
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   317.000  1.510
   96    97   340.000  1.080
   96    98   549.000  1.340
   98    99   340.000  1.080
   98   100   320.000  1.462
  100   101   570.000  1.229
  100   102   214.000  1.327
   87    88   553.000  0.945
   52    53   340.000  1.090
   52    55   268.000  1.529
   52    58   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    75   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   58    59   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    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  110.18000
   29    33    45    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    81.00000  111.40000
   33    45    43    63.00000  111.10000
   33    45    46    37.50000  110.70000
   33    45    47    58.35000  112.70000
   33    39    73    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43   105.00000  110.06700
   42    37    38    83.00000  123.40000
   42    43    44    83.00000  123.40000
   42    43    45    81.00000  111.40000
   43    45    46    35.00000  109.50000
   43    45    47    63.00000  111.10000
   45    33    37    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    47    48    37.50000  110.70000
   45    47    49    58.35000  112.70000
   45    47    52    58.35000  112.70000
   47    45    46    37.50000  110.70000
   47    49    50    50.00000  109.50000
   47    49    51    37.50000  110.70000
   47    49    54    70.00000  112.02700
   47    52    53    37.50000  110.70000
   47    52    55    58.35000  112.70000
   47    52    58    50.00000  109.50000
   49    47    48    37.50000  110.70000
   49    54    60    70.00000  124.00000
   49    54    78    65.00000  116.34900
   51    49    50    45.00000  125.66300
   54    49    50    85.00000  110.90400
   54    49    51    35.00000  109.50000
   54    60    64    65.00000  118.96000
   54    60    66    70.00000  124.00000
   54    78    72    90.00000  111.29400
   54    78    79    80.00000  123.72100
   60    64    65    80.00000  123.72100
   60    64    72    90.00000  111.29400
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    73    70.00000  112.02700
   64    72    78   105.00000  110.06700
   72    64    65    83.00000  123.40000
   72    78    79    83.00000  123.40000
   78    54    60    65.00000  118.96000
   66    60    64    65.00000  116.34900
   66    73    74    37.50000  110.70000
   66    73    39    58.35000  112.70000
   66    73    80    58.35000  112.70000
   68    66    67    33.00000  107.80000
   73    66    67    37.50000  110.70000
   73    66    68    37.50000  110.70000
   73    39    40    37.50000  110.70000
   73    39    41    37.50000  110.70000
   73    80    81    37.50000  110.70000
   73    80    85    58.35000  112.70000
   73    80    87    50.00000  109.50000
   39    33    37    63.00000  111.10000
   39    33    45    58.35000  112.70000
   39    73    74    37.50000  110.70000
   41    39    40    33.00000  107.80000
   80    73    74    37.50000  110.70000
   80    73    39    58.35000  112.70000
   80    85    86    37.50000  110.70000
   80    85    93    58.35000  112.70000
   80    85   102    50.00000  109.50000
   80    87    88    55.00000  108.50000
   85    80    81    37.50000  110.70000
   85    93    94    37.50000  110.70000
   85    93    95    37.50000  110.70000
   85    93    96    70.00000  112.02700
   85   102   100    83.00000  116.90000
   93    85    86    37.50000  110.70000
   93    96    97    35.00000  117.00000
   93    96    98    70.00000  124.00000
   95    93    94    33.00000  107.80000
   96    93    94    35.00000  109.50000
   96    93    95    35.00000  109.50000
   96    98    99    35.00000  120.00000
   96    98   100    65.00000  118.96000
   98    96    97    35.00000  120.00000
   98   100   101    80.00000  123.72100
   98   100   102    90.00000  111.29400
  100    98    99    40.00000  117.72500
  102    85    86    35.00000  109.50000
  102    85    93    50.00000  109.50000
  102   100   101    83.00000  123.40000
   87    80    81    35.00000  109.50000
   87    80    85    50.00000  109.50000
   52    47    48    37.50000  110.70000
   52    47    49    58.35000  112.70000
   52    55    56    37.50000  110.70000
   52    55    57    37.50000  110.70000
   52    55    61    58.35000  112.70000
   52    58    59    55.00000  108.50000
   55    52    53    37.50000  110.70000
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    69    58.35000  112.70000
   57    55    56    33.00000  107.80000
   61    55    56    37.50000  110.70000
   61    55    57    37.50000  110.70000
   61    69    70    37.50000  110.70000
   61    69    71    37.50000  110.70000
   61    69    75    58.35000  112.70000
   63    61    62    33.00000  107.80000
   69    61    62    37.50000  110.70000
   69    61    63    37.50000  110.70000
   69    75    76    37.50000  110.70000
   69    75    77    37.50000  110.70000
   69    75    82    58.35000  112.70000
   71    69    70    33.00000  107.80000
   75    69    70    37.50000  110.70000
   75    69    71    37.50000  110.70000
   75    82    83    37.50000  110.70000
   75    82    84    37.50000  110.70000
   75    82    89    58.35000  112.70000
   77    75    76    33.00000  107.80000
   82    75    76    37.50000  110.70000
   82    75    77    37.50000  110.70000
   82    89    90    37.50000  110.70000
   82    89    91    37.50000  110.70000
   82    89    92    37.50000  110.70000
   84    82    83    33.00000  107.80000
   89    82    83    37.50000  110.70000
   89    82    84    37.50000  110.70000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   58    52    53    35.00000  109.50000
   58    52    55    50.00000  109.50000
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    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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   0.30150 -1.0 2.0
   29    33    37    42   0.40000  1.0 3.0
   29    33    45    43   0.56750  1.0 1.0
   29    33    45    43  -0.07550 -1.0 2.0
   29    33    45    43   0.20000  1.0 3.0
   29    33    45    46   0.15000  1.0 3.0
   29    33    45    47   0.44750  1.0 1.0
   29    33    45    47  -0.17800 -1.0 2.0
   29    33    45    47   0.20200  1.0 3.0
   29    33    39    73   0.44750  1.0 1.0
   29    33    39    73  -0.17800 -1.0 2.0
   29    33    39    73   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37   -42    43   2.00000 -1.0 2.0
   33    45    47    48   0.15000  1.0 3.0
   33    45    47    49   0.56750  1.0 1.0
   33    45    47    49  -0.07550 -1.0 2.0
   33    45    47    49   0.20000  1.0 3.0
   33    45    47    52   0.56750  1.0 1.0
   33    45    47    52  -0.07550 -1.0 2.0
   33    45    47    52   0.20000  1.0 3.0
   37    33   -45    43   0.11950  1.0 1.0
   37    33   -45    43   0.20300 -1.0 2.0
   37    33   -45    43  -0.70800  1.0 3.0
   37    33    45    46  -0.11250  1.0 3.0
   37    33    45    47  -0.95700  1.0 1.0
   37    33    45    47  -0.18200 -1.0 2.0
   37    33    45    47   0.29450  1.0 3.0
   37    33    39    73  -0.95700  1.0 1.0
   37    33    39    73  -0.18200 -1.0 2.0
   37    33    39    73   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    42    43    44   3.00000 -1.0 2.0
   37    42   -43    45   2.00000 -1.0 2.0
   38    37    42    43   3.00000 -1.0 2.0
   42    43   -45    33   0.36750  1.0 3.0
   42    43    45    46   0.00000  1.0 1.0
   42    43    45    47   0.36750  1.0 3.0
   43    45    47    48  -0.11250  1.0 3.0
   43    45    47    49  -0.95700  1.0 1.0
   43    45    47    49  -0.18200 -1.0 2.0
   43    45    47    49   0.29450  1.0 3.0
   43    45    47    52  -0.95700  1.0 1.0
   43    45    47    52  -0.18200 -1.0 2.0
   43    45    47    52   0.29450  1.0 3.0
   44    43    45    33   0.30150 -1.0 2.0
   44    43    45    46   0.00000  1.0 1.0
   44    43    45    47   0.30150 -1.0 2.0
   45    33    37    38   0.30150 -1.0 2.0
   45    33   -37    42   0.36750  1.0 3.0
   45    33    39    73   0.56750  1.0 1.0
   45    33    39    73  -0.07550 -1.0 2.0
   45    33    39    73   0.20000  1.0 3.0
   45    33    39    40   0.15000  1.0 3.0
   45    33    39    41   0.15000  1.0 3.0
   45    47    49    50   0.62750  1.0 1.0
   45    47    49    50  -0.30950 -1.0 2.0
   45    47    49    50   0.27300  1.0 3.0
   45    47    49    51   0.15000  1.0 3.0
   45    47    49    54   0.34400  1.0 1.0
   45    47    49    54   0.09450 -1.0 2.0
   45    47    49    54   0.11100  1.0 3.0
   45    47    52    53   0.15000  1.0 3.0
   45    47    52    55   0.56750  1.0 1.0
   45    47    52    55  -0.07550 -1.0 2.0
   45    47    52    55   0.20000  1.0 3.0
   45    47    52    58   0.86500  1.0 1.0
   45    47    52    58  -0.17500 -1.0 2.0
   45    47    52    58   0.20800  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    52   0.15000  1.0 3.0
   47    49    54    60   0.09850  1.0 1.0
   47    49    54    60   0.15250 -1.0 2.0
   47    49    54    60  -0.50650  1.0 3.0
   47    49    54    78   0.09700  1.0 1.0
   47    49    54    78   0.15600 -1.0 2.0
   47    49    54    78  -0.50800  1.0 3.0
   47    52    55    56   0.15000  1.0 3.0
   47    52    55    57   0.15000  1.0 3.0
   47    52    55    61   0.56750  1.0 1.0
   47    52    55    61  -0.07550 -1.0 2.0
   47    52    55    61   0.20000  1.0 3.0
   47    52    58    59  -0.11600  1.0 1.0
   47    52    58    59  -0.09450 -1.0 2.0
   47    52    58    59   0.21250  1.0 3.0
   48    47    49    50   0.23400  1.0 3.0
   48    47    49    51   0.15000  1.0 3.0
   48    47    49    54   0.15000  1.0 3.0
   48    47    52    53   0.15000  1.0 3.0
   48    47    52    55   0.15000  1.0 3.0
   48    47    52    58   0.23400  1.0 3.0
   49    47    52    53   0.15000  1.0 3.0
   49    47    52    55   0.56750  1.0 1.0
   49    47    52    55  -0.07550 -1.0 2.0
   49    47    52    55   0.20000  1.0 3.0
   49    47    52    58   0.86500  1.0 1.0
   49    47    52    58  -0.17500 -1.0 2.0
   49    47    52    58   0.20800  1.0 3.0
   49    54    60    64   7.00000 -1.0 2.0
   49    54    60    66   7.00000 -1.0 2.0
   49    54    78    72  -0.15000  1.0 1.0
   49    54    78    72   0.89550 -1.0 2.0
   49    54    78    72  -0.06900  1.0 3.0
   49    54    78    79  -0.64400  1.0 1.0
   49    54    78    79   0.26850 -1.0 2.0
   50    49    54    60   0.39000  1.0 1.0
   50    49    54    60  -0.05800 -1.0 2.0
   50    49    54    60  -0.55150  1.0 3.0
   50    49    54    78   0.09700  1.0 1.0
   50    49    54    78   0.15600 -1.0 2.0
   50    49    54    78  -0.50800  1.0 3.0
   51    49    54    60   0.00000  1.0 1.0
   51    49    54    78   0.15000  1.0 3.0
   54    60    64    65   1.00000 -1.0 2.0
   54    60   -64    72  -0.56150  1.0 1.0
   54    60   -64    72   2.19150 -1.0 2.0
   54    60    66    67   0.00000  1.0 1.0
   54    60    66    68   0.00000  1.0 1.0
   54    60    66    73   0.09850  1.0 1.0
   54    60    66    73   0.15250 -1.0 2.0
   54    60    66    73  -0.50650  1.0 3.0
   60    54   -78    72  -0.56150  1.0 1.0
   60    54   -78    72   2.19150 -1.0 2.0
   60    54    78    79   1.00000 -1.0 2.0
   60    64   -72    78   2.00000 -1.0 2.0
   60    66    73    74   0.15000  1.0 3.0
   60    66    73    39   0.34400  1.0 1.0
   60    66    73    39   0.09450 -1.0 2.0
   60    66    73    39   0.11100  1.0 3.0
   60    66    73    80   0.34400  1.0 1.0
   60    66    73    80   0.09450 -1.0 2.0
   60    66    73    80   0.11100  1.0 3.0
   64    60    66    67   0.15000  1.0 3.0
   64    60    66    68   0.15000  1.0 3.0
   64    60    66    73   0.09700  1.0 1.0
   64    60    66    73   0.15600 -1.0 2.0
   64    60    66    73  -0.50800  1.0 3.0
   64    72   -78    54   2.00000 -1.0 2.0
   64    72    78    79   3.00000 -1.0 2.0
   65    64    72    78   3.00000 -1.0 2.0
   78    54   -60    64   7.00000 -1.0 2.0
   78    54    60    66   7.00000 -1.0 2.0
   66    60    64    65  -0.64400  1.0 1.0
   66    60    64    65   0.26850 -1.0 2.0
   66    60    64    72  -0.15000  1.0 1.0
   66    60    64    72   0.89550 -1.0 2.0
   66    60    64    72  -0.06900  1.0 3.0
   66    73    39    33   0.56750  1.0 1.0
   66    73    39    33  -0.07550 -1.0 2.0
   66    73    39    33   0.20000  1.0 3.0
   66    73    39    40   0.15000  1.0 3.0
   66    73    39    41   0.15000  1.0 3.0
   66    73    80    81   0.15000  1.0 3.0
   66    73    80    85   0.56750  1.0 1.0
   66    73    80    85  -0.07550 -1.0 2.0
   66    73    80    85   0.20000  1.0 3.0
   66    73    80    87   0.86500  1.0 1.0
   66    73    80    87  -0.17500 -1.0 2.0
   66    73    80    87   0.20800  1.0 3.0
   67    66    73    74   0.15000  1.0 3.0
   67    66    73    39   0.15000  1.0 3.0
   67    66    73    80   0.15000  1.0 3.0
   68    66    73    74   0.15000  1.0 3.0
   68    66    73    39   0.15000  1.0 3.0
   68    66    73    80   0.15000  1.0 3.0
   73    80    85    86   0.15000  1.0 3.0
   73    80    85    93   0.56750  1.0 1.0
   73    80    85    93  -0.07550 -1.0 2.0
   73    80    85    93   0.20000  1.0 3.0
   73    80    85   102   0.62750  1.0 1.0
   73    80    85   102  -0.30950 -1.0 2.0
   73    80    85   102   0.27300  1.0 3.0
   73    80    87    88  -0.11600  1.0 1.0
   73    80    87    88  -0.09450 -1.0 2.0
   73    80    87    88   0.21250  1.0 3.0
   74    73    39    33   0.15000  1.0 3.0
   74    73    39    40   0.15000  1.0 3.0
   74    73    39    41   0.15000  1.0 3.0
   74    73    80    81   0.15000  1.0 3.0
   74    73    80    85   0.15000  1.0 3.0
   74    73    80    87   0.23400  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   0.36750  1.0 3.0
   39    33    45    43  -0.95700  1.0 1.0
   39    33    45    43  -0.18200 -1.0 2.0
   39    33    45    43   0.29450  1.0 3.0
   39    33    45    46   0.15000  1.0 3.0
   39    33    45    47   0.56750  1.0 1.0
   39    33    45    47  -0.07550 -1.0 2.0
   39    33    45    47   0.20000  1.0 3.0
   39    73    80    81   0.15000  1.0 3.0
   39    73    80    85   0.56750  1.0 1.0
   39    73    80    85  -0.07550 -1.0 2.0
   39    73    80    85   0.20000  1.0 3.0
   39    73    80    87   0.86500  1.0 1.0
   39    73    80    87  -0.17500 -1.0 2.0
   39    73    80    87   0.20800  1.0 3.0
   80    73    39    33   0.56750  1.0 1.0
   80    73    39    33  -0.07550 -1.0 2.0
   80    73    39    33   0.20000  1.0 3.0
   80    73    39    40   0.15000  1.0 3.0
   80    73    39    41   0.15000  1.0 3.0
   80    85    93    94   0.15000  1.0 3.0
   80    85    93    95   0.15000  1.0 3.0
   80    85    93    96   0.34400  1.0 1.0
   80    85    93    96   0.09450 -1.0 2.0
   80    85    93    96   0.11100  1.0 3.0
   80    85   102   100  -0.25900  1.0 1.0
   80    85   102   100  -0.47000 -1.0 2.0
   80    85   102   100   0.11750  1.0 3.0
   81    80    85    86   0.15000  1.0 3.0
   81    80    85    93   0.15000  1.0 3.0
   81    80    85   102   0.23400  1.0 3.0
   81    80    87    88   0.19450  1.0 3.0
   85    80    87    88  -0.11600  1.0 1.0
   85    80    87    88  -0.09450 -1.0 2.0
   85    80    87    88   0.21250  1.0 3.0
   85    93    96    97   0.00000  1.0 1.0
   85    93    96    98   0.09850  1.0 1.0
   85    93    96    98   0.15250 -1.0 2.0
   85    93    96    98  -0.50650  1.0 3.0
   86    85    93    94   0.15000  1.0 3.0
   86    85    93    95   0.15000  1.0 3.0
   86    85    93    96   0.15000  1.0 3.0
   86    85   102   100   0.08050  1.0 3.0
   93    85   102   100  -0.25900  1.0 1.0
   93    85   102   100  -0.47000 -1.0 2.0
   93    85   102   100   0.11750  1.0 3.0
   93    96    98    99   7.00000 -1.0 2.0
   93    96   -98   100   7.00000 -1.0 2.0
   94    93    96    97   0.33100  1.0 3.0
   94    93    96    98   0.00000  1.0 1.0
   95    93    96    97   0.33100  1.0 3.0
   95    93    96    98   0.00000  1.0 1.0
   96    98   100   101   1.00000 -1.0 2.0
   96    98   100   102  -0.56150  1.0 1.0
   96    98   100   102   2.19150 -1.0 2.0
   97    96    98    99   7.00000 -1.0 2.0
   97    96    98   100   7.00000 -1.0 2.0
   98   100  -102    85   2.00000 -1.0 2.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   1.63100 -1.0 2.0
  101   100   102    85   3.00000 -1.0 2.0
  102    85    93    94   0.23400  1.0 3.0
  102    85    93    95   0.23400  1.0 3.0
  102    85   -93    96   0.61850  1.0 1.0
  102    85   -93    96  -0.22750 -1.0 2.0
  102    85   -93    96   0.15300  1.0 3.0
   87    80    85    86   0.23400  1.0 3.0
   87    80    85    93   0.86500  1.0 1.0
   87    80    85    93  -0.17500 -1.0 2.0
   87    80    85    93   0.20800  1.0 3.0
   87    80    85   102   3.69350  1.0 1.0
   87    80    85   102  -1.82950 -1.0 2.0
   52    47    49    50   0.62750  1.0 1.0
   52    47    49    50  -0.30950 -1.0 2.0
   52    47    49    50   0.27300  1.0 3.0
   52    47    49    51   0.15000  1.0 3.0
   52    47    49    54   0.34400  1.0 1.0
   52    47    49    54   0.09450 -1.0 2.0
   52    47    49    54   0.11100  1.0 3.0
   52    55    61    62   0.15000  1.0 3.0
   52    55    61    63   0.15000  1.0 3.0
   52    55    61    69   0.56750  1.0 1.0
   52    55    61    69  -0.07550 -1.0 2.0
   52    55    61    69   0.20000  1.0 3.0
   53    52    55    56   0.15000  1.0 3.0
   53    52    55    57   0.15000  1.0 3.0
   53    52    55    61   0.15000  1.0 3.0
   53    52    58    59   0.19450  1.0 3.0
   55    52    58    59  -0.11600  1.0 1.0
   55    52    58    59  -0.09450 -1.0 2.0
   55    52    58    59   0.21250  1.0 3.0
   55    61    69    70   0.15000  1.0 3.0
   55    61    69    71   0.15000  1.0 3.0
   55    61    69    75   0.56750  1.0 1.0
   55    61    69    75  -0.07550 -1.0 2.0
   55    61    69    75   0.20000  1.0 3.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    63   0.15000  1.0 3.0
   56    55    61    69   0.15000  1.0 3.0
   57    55    61    62   0.15000  1.0 3.0
   57    55    61    63   0.15000  1.0 3.0
   57    55    61    69   0.15000  1.0 3.0
   61    69    75    76   0.15000  1.0 3.0
   61    69    75    77   0.15000  1.0 3.0
   61    69    75    82   0.56750  1.0 1.0
   61    69    75    82  -0.07550 -1.0 2.0
   61    69    75    82   0.20000  1.0 3.0
   62    61    69    70   0.15000  1.0 3.0
   62    61    69    71   0.15000  1.0 3.0
   62    61    69    75   0.15000  1.0 3.0
   63    61    69    70   0.15000  1.0 3.0
   63    61    69    71   0.15000  1.0 3.0
   63    61    69    75   0.15000  1.0 3.0
   69    75    82    83   0.15000  1.0 3.0
   69    75    82    84   0.15000  1.0 3.0
   69    75    82    89   0.56750  1.0 1.0
   69    75    82    89  -0.07550 -1.0 2.0
   69    75    82    89   0.20000  1.0 3.0
   70    69    75    76   0.15000  1.0 3.0
   70    69    75    77   0.15000  1.0 3.0
   70    69    75    82   0.15000  1.0 3.0
   71    69    75    76   0.15000  1.0 3.0
   71    69    75    77   0.15000  1.0 3.0
   71    69    75    82   0.15000  1.0 3.0
   75    82    89    90   0.15000  1.0 3.0
   75    82    89    91   0.15000  1.0 3.0
   75    82    89    92   0.15000  1.0 3.0
   76    75    82    83   0.15000  1.0 3.0
   76    75    82    84   0.15000  1.0 3.0
   76    75    82    89   0.15000  1.0 3.0
   77    75    82    83   0.15000  1.0 3.0
   77    75    82    84   0.15000  1.0 3.0
   77    75    82    89   0.15000  1.0 3.0
   83    82    89    90   0.15000  1.0 3.0
   83    82    89    91   0.15000  1.0 3.0
   83    82    89    92   0.15000  1.0 3.0
   84    82    89    90   0.15000  1.0 3.0
   84    82    89    91   0.15000  1.0 3.0
   84    82    89    92   0.15000  1.0 3.0
   58    52    55    56   0.23400  1.0 3.0
   58    52    55    57   0.23400  1.0 3.0
   58    52    55    61   0.86500  1.0 1.0
   58    52    55    61  -0.17500 -1.0 2.0
   58    52    55    61   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    38  10.50000 -1.0 2.0
   42    45    43    44  10.50000 -1.0 2.0
   49    78    54    60   1.10000 -1.0 2.0
   64    66    60    54   1.10000 -1.0 2.0
   60    72    64    65  10.50000 -1.0 2.0
   54    72    78    79  10.50000 -1.0 2.0
   93    97    96    98   1.10000 -1.0 2.0
  100    99    98    96   1.10000 -1.0 2.0
   98   102   100   101  10.50000 -1.0 2.0
END
