* LIGAND DATABASE FILE (OPLS2005)
*
001     102   105    195    314     586
    1     0 S   NP   _N1_     1    28.88157    93.68521   -23.43735
    2     1 S   H    _HN1     2     1.02955    86.40729    29.52283
    3     1 S   H    _H1_     3     1.02824    23.64023  -179.15953
    4     1 S   H    _H2_     4     1.02778   104.95217   -78.51840
    5     1 S   CT   _CA1     5     1.50146   130.58471   143.40923
    6     5 S   HC   _HA1     6     1.09573   105.19090    74.30308
    7     5 S   CO3  _C1_     7     1.53787   112.43068   -45.86025
    8     7 S   O2Z  _O11     8     1.26370   114.99832   -41.70190
    9     7 S   O2Z  _O12     9     1.26241   114.95691   137.33123
   10     5 S   CT   _CB1    10     1.53064   107.37174  -167.76404
   11    10 S   HC   HB11    11     1.09830   109.29958   -49.90198
   12    10 S   HC   HB12    12     1.09828   110.45106    66.65833
   13    10 S   CT   _CG1    13     1.52998   112.69542  -170.95608
   14    13 S   HC   HG11    14     1.09587   110.50294   -65.44681
   15    13 S   HC   HG12    15     1.09660   109.96500    53.85582
   16    13 S   C    _CD1    16     1.51763   112.18453   174.15125
   17    16 S   O    _OE1    17     1.22752   123.24443     1.39353
   18    16 S   N    _N2_    18     1.38698   111.70301  -178.68657
   19    18 S   H    _HN2    19     1.01588   119.21818     0.40830
   20    18 S   CT1  _CA2    20     1.46059   122.94171   178.94854
   21    20 S   HC   _HA2    21     1.09540   108.93582    -9.13080
   22    20 S   C    _C2_    22     1.53473   109.27379  -124.95243
   23    22 S   O    _O2_    23     1.23087   122.06161  -154.63975
   24    20 S   CT   _CB2    32     1.53473   112.15716   112.36377
   25    24 S   HC   HB21    33     1.09572   109.47100    60.48314
   26    24 S   HC   HB22    34     1.09241   109.59744   178.33376
   27    22 S   N    _N3_    24     1.38257   113.86471    32.46984
   28    27 S   H    _HN3    25     1.01624   119.42301    -1.85846
   29    24 S   S    _SG2    35     1.83220   111.68069   -59.02622
   30    27 S   CT   _CA3    26     1.45256   123.17313   176.57023
   31    30 S   HC   HA31    27     1.09556   107.45087   -65.30465
   32    30 S   HC   HA32    28     1.09557   108.02100    51.09235
   33    29 S   CT   _C19    36     1.88021   104.07853  -150.81628
   34    30 S   CO3  _C3_    29     1.52929   114.17274   173.19119
   35    34 S   O2Z  _O31    30     1.26365   116.11486    -0.33338
   36    34 S   O2Z  _O32    31     1.26451   114.39600   179.79252
   37    33 S   CO4  _C20    37     1.52282   104.39465   -38.33612
   38    37 S   O    _O33    38     1.22382   126.76008   -48.13621
   39    33 S   CT   _C11    62     1.61962   109.30438  -155.94621
   40    39 S   HC   _H4_    63     1.10368   103.59174    43.22099
   41    37 S   OS   _O34    39     1.35611   110.14354   132.69816
   42    39 S   CT   _C10    64     1.59366   115.02924   155.38003
   43    42 S   HC   _H3_    65     1.09637   109.14787    62.17045
   44    41 S   CO4  _C21    40     1.35174   111.61616    -4.03551
   45    44 S   O    _O35    41     1.22286   123.68310   176.74556
   46    42 S   CT   _C9_    66     1.54689   113.79625  -174.52557
   47    46 S   HC   _H21    67     1.09756   109.04913    59.34321
   48    46 S   HC   _H22    68     1.09302   111.15637   -58.72955
   49    42 S   OH   _O43    85     1.42642   110.36499   -55.34055
   50    49 S   HO   _H32    86     0.97206   107.92590   159.57616
   51    33 S   CT   _C18    42     1.54459   116.65617    74.41028
   52    51 S   HC   _H7_    43     1.09014   110.53926   124.79218
   53    46 S   CT   _C8_    69     1.53575   113.15128   179.96574
   54    53 S   HC   _H19    70     1.09591   110.18115   -63.97054
   55    53 S   HC   _H20    71     1.09659   109.48781    53.96834
   56    51 S   CT   _C17    44     1.54531   123.08576    -4.85438
   57    56 S   HC   _H25    45     1.10065   105.78574  -172.50896
   58    56 S   HC   _H26    46     1.09573   109.44401   -61.16310
   59    53 S   CT   _C7_    72     1.53092   111.22713   175.17395
   60    59 S   HC   _H17    73     1.09681   109.53797    58.39267
   61    59 S   HC   _H18    74     1.09680   109.60161   -58.91741
   62    56 S   CT   _C16    47     1.55503   121.47862    66.58444
   63    62 S   HC   _H6_    48     1.09649   108.29430   -88.12301
   64    59 S   CT   _C6_    75     1.52960   111.32861   179.76930
   65    64 S   HC   _H15    76     1.09684   109.58274   -58.67829
   66    64 S   HC   _H16    77     1.09684   109.56957    58.59238
   67    62 S   CT   _C15    49     1.55081   113.92898    32.43780
   68    67 S   HC   _H23    50     1.09720   111.19513   142.62299
   69    67 S   HC   _H24    51     1.09197   109.98472    28.81045
   70    64 S   CT   _C5_    78     1.52845   111.32721   179.96044
   71    70 S   HC   _H13    79     1.09622   109.86735   -58.85981
   72    70 S   HC   _H14    80     1.09622   109.86478    58.86893
   73    62 S   CT   _C22    87     1.56409   110.14313   156.05878
   74    73 S   HC   _H8_    88     1.09707   108.67368   -65.86439
   75    67 S   CM   _C14    52     1.49737   112.51406   -97.85262
   76    70 S   CT   _C4_    81     1.52037   111.49356  -180.00000
   77    76 S   HC   _H10    82     1.09469   111.00113   -60.25811
   78    76 S   HC   _H11    83     1.09469   111.00078    60.26140
   79    76 S   HC   _H12    84     1.09449   110.26152  -180.00000
   80    73 S   CT   _C23    89     1.54270   115.26633    56.52328
   81    80 S   HC   _H9_    90     1.09681   109.68416   -56.21392
   82    73 S   OH   _O38   101     1.43290   109.18048   178.22084
   83    82 S   HO   _H31   102     0.97393   107.46439   -57.98788
   84    75 S   CM   _C13    53     1.33951   132.18491   102.53028
   85    80 S   CT   _C24    91     1.52944   111.74932  -177.46874
   86    85 S   HC   _H27    92     1.09556   109.62907    67.61069
   87    85 S   HC   _H28    93     1.09576   112.25339   -52.26317
   88    84 S   CO4  _C29    54     1.47529   106.67793  -179.32885
   89    88 S   O    _O41    55     1.21821   126.70503   179.06644
   90    84 S   CT   _C12    59     1.51168   133.32875     0.96205
   91    90 S   OM   _O42    60     1.32269   107.83953    38.44355
   92    90 S   HC   _H5_    61     1.10189   103.67038   161.64394
   93    85 S   CM   _C25    94     1.49122   108.89036  -172.00385
   94    93 S   HC   _H29    95     1.08538   118.66657  -151.86240
   95    88 S   OS   _O40    56     1.35270   107.85702    -0.63211
   96    93 S   CM   _C26    96     1.33634   121.33513    28.68726
   97    96 S   HC   _H30    97     1.08352   121.53142   178.68493
   98    75 S   CO4  _C28    57     1.46796   119.91189   -77.47849
   99    98 S   O    _O39    58     1.21797   126.44173    -0.48618
  100    96 S   CO4  _C27    98     1.47344   120.46277     3.82264
  101   100 S   O    _O36    99     1.22538   120.61467   164.82685
  102    80 S   OS   _O37   100     1.44732   108.60628    60.89417
  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
  21   2   1   1  11   4  20   9   5  15   7   7   3  12   6   5
   3   1   9   4   9   5   4  12   5   4   9   5   4  15   8   9
   5   4  13   5   4   6   5   4  12   6   9   3   2   1   1  12
   7   3   1   8   8   5   4   7   3   4   1   1   6   3   2   4
   3   1   1   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    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    44    51    52    56    90    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    44    45    51    52    56    57    58    62    84    90    91    92    39    40    42    43    46    49  
   35    36  
   36  
    0  
   38    41    44    45    51    52    56    90    39    40    42  
   41    44    51    39  
   40    42    43    46    47    48    53    49    50    41    44    51    52    56    75    84    88    90    91    92  
   42    43    46    49    51    84    90    91    92  
   44    45    51    52    56  
   43    46    47    48    53    54    55    59    49    50    51    84    90    91    92  
   46    47    48    53    49    50    90  
   45    51    52    56    57    58    62  
   51    52    56  
   47    48    53    54    55    59    60    61    64    49    50    90  
   48    53    54    55    59    49  
   53    54    55    59    49  
   50    53    90  
    0  
   52    56    57    58    62    63    67    90    73  
   56    57    58    62  
   54    55    59    60    61    64    65    66    70  
   55    59    60    61    64  
   59    60    61    64  
   57    58    62    63    67    68    69    75    73    74    80    82  
   58    62    63    67    73  
   62    63    67    73  
   60    61    64    65    66    70    71    72    76  
   61    64    65    66    70  
   64    65    66    70  
   63    67    68    69    75    84    98    73    74    80    81    85   102    82    83  
   67    68    69    75    73    74    80    82  
   65    66    70    71    72    76    77    78    79  
   66    70    71    72    76  
   70    71    72    76  
   68    69    75    84    88    95    98    99    90    73    74    80    82  
   69    75    84    98    73  
   75    84    98    73  
   71    72    76    77    78    79  
   72    76    77    78    79  
   76    77    78    79  
   74    80    81    85    86    87    93   100   102    82    83    75  
   80    81    85   102    82    83  
   84    88    89    95    98    99    90    91    92  
   77    78    79  
   78    79  
   79  
    0  
   81    85    86    87    93    94    96   100   101   102    82    83  
   85    86    87    93   100   102    82  
   83    85   102  
    0  
   88    89    95    98    99    90    91    92  
   86    87    93    94    96    97   100   102  
   87    93    94    96   102  
   93    94    96   102  
   89    95    98    99    90    91    92  
   95    98    90  
   91    92    95    98  
   92  
    0  
   94    96    97   100   101   102  
   96    97   100  
   98    99  
   97   100   101   102  
  100   101   102  
   99  
    0  
  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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   42   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   76   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   82   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   84   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   85   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   91   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   92   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   94   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   95   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  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    51   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   214.000  1.327
   41    44   214.000  1.327
   44    45   570.000  1.229
   44    51   317.000  1.522
   51    52   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    62   268.000  1.529
   62    63   340.000  1.090
   62    67   268.000  1.529
   62    73   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    75   317.000  1.510
   75    84   549.000  1.340
   75    98   320.000  1.462
   84    88   320.000  1.462
   84    90   317.000  1.510
   88    89   570.000  1.229
   88    95   214.000  1.327
   95    98   214.000  1.327
   98    99   570.000  1.229
   90    91   570.000  1.307
   90    92   340.000  1.090
   90    39   268.000  1.529
   39    40   340.000  1.090
   39    42   268.000  1.529
   42    43   340.000  1.090
   42    46   268.000  1.529
   42    49   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    76   268.000  1.529
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   49    50   553.000  0.945
   73    74   340.000  1.090
   73    80   268.000  1.529
   73    82   320.000  1.410
   80    81   340.000  1.090
   80    85   268.000  1.529
   80   102   320.000  1.410
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    93   317.000  1.510
   93    94   340.000  1.080
   93    96   549.000  1.340
   96    97   340.000  1.080
   96   100   320.000  1.462
  100   101   570.000  1.229
  100   102   214.000  1.327
   82    83   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    51    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    81.00000  111.40000
   33    51    44    63.00000  111.10000
   33    51    52    37.50000  110.70000
   33    51    56    58.35000  112.70000
   33    39    90    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    42    58.35000  112.70000
   37    41    44   105.00000  110.06700
   41    37    38    83.00000  123.40000
   41    44    45    83.00000  123.40000
   41    44    51    81.00000  111.40000
   44    51    52    35.00000  109.50000
   44    51    56    63.00000  111.10000
   51    33    37    63.00000  111.10000
   51    44    45    80.00000  120.40000
   51    56    57    37.50000  110.70000
   51    56    58    37.50000  110.70000
   51    56    62    58.35000  112.70000
   56    51    52    37.50000  110.70000
   56    62    63    37.50000  110.70000
   56    62    67    58.35000  112.70000
   56    62    73    58.35000  112.70000
   58    56    57    33.00000  107.80000
   62    56    57    37.50000  110.70000
   62    56    58    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    75    70.00000  112.02700
   62    73    74    37.50000  110.70000
   62    73    80    58.35000  112.70000
   62    73    82    50.00000  109.50000
   67    62    63    37.50000  110.70000
   67    75    84    70.00000  124.00000
   67    75    98    65.00000  116.34900
   69    67    68    33.00000  107.80000
   75    67    68    35.00000  109.50000
   75    67    69    35.00000  109.50000
   75    84    88    65.00000  118.96000
   75    84    90    70.00000  124.00000
   75    98    95    90.00000  111.29400
   75    98    99    80.00000  123.72100
   84    88    89    80.00000  123.72100
   84    88    95    90.00000  111.29400
   84    90    91    85.00000  110.90400
   84    90    92    35.00000  109.50000
   84    90    39    70.00000  112.02700
   88    95    98   105.00000  110.06700
   95    88    89    83.00000  123.40000
   95    98    99    83.00000  123.40000
   98    75    84    65.00000  118.96000
   90    84    88    65.00000  116.34900
   90    39    40    37.50000  110.70000
   90    39    42    58.35000  112.70000
   92    90    91    45.00000  125.66300
   39    33    37    63.00000  111.10000
   39    33    51    58.35000  112.70000
   39    90    91    50.00000  109.50000
   39    90    92    37.50000  110.70000
   39    42    43    37.50000  110.70000
   39    42    46    58.35000  112.70000
   39    42    49    50.00000  109.50000
   42    39    40    37.50000  110.70000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    53    58.35000  112.70000
   42    49    50    55.00000  108.50000
   46    42    43    37.50000  110.70000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    59    58.35000  112.70000
   48    46    47    33.00000  107.80000
   53    46    47    37.50000  110.70000
   53    46    48    37.50000  110.70000
   53    59    60    37.50000  110.70000
   53    59    61    37.50000  110.70000
   53    59    64    58.35000  112.70000
   55    53    54    33.00000  107.80000
   59    53    54    37.50000  110.70000
   59    53    55    37.50000  110.70000
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    70    58.35000  112.70000
   61    59    60    33.00000  107.80000
   64    59    60    37.50000  110.70000
   64    59    61    37.50000  110.70000
   64    70    71    37.50000  110.70000
   64    70    72    37.50000  110.70000
   64    70    76    58.35000  112.70000
   66    64    65    33.00000  107.80000
   70    64    65    37.50000  110.70000
   70    64    66    37.50000  110.70000
   70    76    77    37.50000  110.70000
   70    76    78    37.50000  110.70000
   70    76    79    37.50000  110.70000
   72    70    71    33.00000  107.80000
   76    70    71    37.50000  110.70000
   76    70    72    37.50000  110.70000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   49    42    43    35.00000  109.50000
   49    42    46    50.00000  109.50000
   73    62    63    37.50000  110.70000
   73    62    67    58.35000  112.70000
   73    80    81    37.50000  110.70000
   73    80    85    58.35000  112.70000
   73    80   102    50.00000  109.50000
   73    82    83    55.00000  108.50000
   80    73    74    37.50000  110.70000
   80    85    86    37.50000  110.70000
   80    85    87    37.50000  110.70000
   80    85    93    70.00000  112.02700
   80   102   100    83.00000  116.90000
   85    80    81    37.50000  110.70000
   85    93    94    35.00000  117.00000
   85    93    96    70.00000  124.00000
   87    85    86    33.00000  107.80000
   93    85    86    35.00000  109.50000
   93    85    87    35.00000  109.50000
   93    96    97    35.00000  120.00000
   93    96   100    65.00000  118.96000
   96    93    94    35.00000  120.00000
   96   100   101    80.00000  123.72100
   96   100   102    90.00000  111.29400
  100    96    97    40.00000  117.72500
  102    80    81    35.00000  109.50000
  102    80    85    50.00000  109.50000
  102   100   101    83.00000  123.40000
   82    73    74    35.00000  109.50000
   82    73    80    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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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    41   0.40000  1.0 3.0
   29    33    51    44   0.56750  1.0 1.0
   29    33    51    44  -0.07550 -1.0 2.0
   29    33    51    44   0.20000  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    56   0.44750  1.0 1.0
   29    33    51    56  -0.17800 -1.0 2.0
   29    33    51    56   0.20200  1.0 3.0
   29    33    39    90   0.44750  1.0 1.0
   29    33    39    90  -0.17800 -1.0 2.0
   29    33    39    90   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   33    37   -41    44   2.00000 -1.0 2.0
   33    51    56    57   0.15000  1.0 3.0
   33    51    56    58   0.15000  1.0 3.0
   33    51    56    62   0.56750  1.0 1.0
   33    51    56    62  -0.07550 -1.0 2.0
   33    51    56    62   0.20000  1.0 3.0
   33    39    42    43   0.15000  1.0 3.0
   33    39    42    46   0.56750  1.0 1.0
   33    39    42    46  -0.07550 -1.0 2.0
   33    39    42    46   0.20000  1.0 3.0
   33    39    42    49   0.86500  1.0 1.0
   33    39    42    49  -0.17500 -1.0 2.0
   33    39    42    49   0.20800  1.0 3.0
   37    33   -51    44   0.11950  1.0 1.0
   37    33   -51    44   0.20300 -1.0 2.0
   37    33   -51    44  -0.70800  1.0 3.0
   37    33    51    52  -0.11250  1.0 3.0
   37    33    51    56  -0.95700  1.0 1.0
   37    33    51    56  -0.18200 -1.0 2.0
   37    33    51    56   0.29450  1.0 3.0
   37    33    39    90  -0.95700  1.0 1.0
   37    33    39    90  -0.18200 -1.0 2.0
   37    33    39    90   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    42  -0.95700  1.0 1.0
   37    33    39    42  -0.18200 -1.0 2.0
   37    33    39    42   0.29450  1.0 3.0
   37    41    44    45   3.00000 -1.0 2.0
   37    41   -44    51   2.00000 -1.0 2.0
   38    37    41    44   3.00000 -1.0 2.0
   41    44   -51    33   0.36750  1.0 3.0
   41    44    51    52   0.00000  1.0 1.0
   41    44    51    56   0.36750  1.0 3.0
   44    51    56    57  -0.11250  1.0 3.0
   44    51    56    58  -0.11250  1.0 3.0
   44    51    56    62  -0.95700  1.0 1.0
   44    51    56    62  -0.18200 -1.0 2.0
   44    51    56    62   0.29450  1.0 3.0
   45    44    51    33   0.30150 -1.0 2.0
   45    44    51    52   0.00000  1.0 1.0
   45    44    51    56   0.30150 -1.0 2.0
   51    33    37    38   0.30150 -1.0 2.0
   51    33   -37    41   0.36750  1.0 3.0
   51    33    39    90   0.56750  1.0 1.0
   51    33    39    90  -0.07550 -1.0 2.0
   51    33    39    90   0.20000  1.0 3.0
   51    33    39    40   0.15000  1.0 3.0
   51    33    39    42   0.56750  1.0 1.0
   51    33    39    42  -0.07550 -1.0 2.0
   51    33    39    42   0.20000  1.0 3.0
   51    56    62    63   0.15000  1.0 3.0
   51    56    62    67   0.56750  1.0 1.0
   51    56    62    67  -0.07550 -1.0 2.0
   51    56    62    67   0.20000  1.0 3.0
   51    56    62    73   0.56750  1.0 1.0
   51    56    62    73  -0.07550 -1.0 2.0
   51    56    62    73   0.20000  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   52    51    56    62   0.15000  1.0 3.0
   56    62    67    68   0.15000  1.0 3.0
   56    62    67    69   0.15000  1.0 3.0
   56    62    67    75   0.34400  1.0 1.0
   56    62    67    75   0.09450 -1.0 2.0
   56    62    67    75   0.11100  1.0 3.0
   56    62    73    74   0.15000  1.0 3.0
   56    62    73    80   0.56750  1.0 1.0
   56    62    73    80  -0.07550 -1.0 2.0
   56    62    73    80   0.20000  1.0 3.0
   56    62    73    82   0.86500  1.0 1.0
   56    62    73    82  -0.17500 -1.0 2.0
   56    62    73    82   0.20800  1.0 3.0
   57    56    62    63   0.15000  1.0 3.0
   57    56    62    67   0.15000  1.0 3.0
   57    56    62    73   0.15000  1.0 3.0
   58    56    62    63   0.15000  1.0 3.0
   58    56    62    67   0.15000  1.0 3.0
   58    56    62    73   0.15000  1.0 3.0
   62    67    75    84   0.09850  1.0 1.0
   62    67    75    84   0.15250 -1.0 2.0
   62    67    75    84  -0.50650  1.0 3.0
   62    67    75    98   0.09700  1.0 1.0
   62    67    75    98   0.15600 -1.0 2.0
   62    67    75    98  -0.50800  1.0 3.0
   62    73    80    81   0.15000  1.0 3.0
   62    73    80    85   0.56750  1.0 1.0
   62    73    80    85  -0.07550 -1.0 2.0
   62    73    80    85   0.20000  1.0 3.0
   62    73    80   102   0.62750  1.0 1.0
   62    73    80   102  -0.30950 -1.0 2.0
   62    73    80   102   0.27300  1.0 3.0
   62    73    82    83  -0.11600  1.0 1.0
   62    73    82    83  -0.09450 -1.0 2.0
   62    73    82    83   0.21250  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    75   0.15000  1.0 3.0
   63    62    73    74   0.15000  1.0 3.0
   63    62    73    80   0.15000  1.0 3.0
   63    62    73    82   0.23400  1.0 3.0
   67    62    73    74   0.15000  1.0 3.0
   67    62    73    80   0.56750  1.0 1.0
   67    62    73    80  -0.07550 -1.0 2.0
   67    62    73    80   0.20000  1.0 3.0
   67    62    73    82   0.86500  1.0 1.0
   67    62    73    82  -0.17500 -1.0 2.0
   67    62    73    82   0.20800  1.0 3.0
   67    75    84    88   7.00000 -1.0 2.0
   67    75    84    90   7.00000 -1.0 2.0
   67    75    98    95  -0.15000  1.0 1.0
   67    75    98    95   0.89550 -1.0 2.0
   67    75    98    95  -0.06900  1.0 3.0
   67    75    98    99  -0.64400  1.0 1.0
   67    75    98    99   0.26850 -1.0 2.0
   68    67    75    84   0.00000  1.0 1.0
   68    67    75    98   0.15000  1.0 3.0
   69    67    75    84   0.00000  1.0 1.0
   69    67    75    98   0.15000  1.0 3.0
   75    84    88    89   1.00000 -1.0 2.0
   75    84   -88    95  -0.56150  1.0 1.0
   75    84   -88    95   2.19150 -1.0 2.0
   75    84    90    91   0.39000  1.0 1.0
   75    84    90    91  -0.05800 -1.0 2.0
   75    84    90    91  -0.55150  1.0 3.0
   75    84    90    92   0.00000  1.0 1.0
   75    84    90    39   0.09850  1.0 1.0
   75    84    90    39   0.15250 -1.0 2.0
   75    84    90    39  -0.50650  1.0 3.0
   84    75   -98    95  -0.56150  1.0 1.0
   84    75   -98    95   2.19150 -1.0 2.0
   84    75    98    99   1.00000 -1.0 2.0
   84    88   -95    98   2.00000 -1.0 2.0
   84    90    39    33   0.34400  1.0 1.0
   84    90    39    33   0.09450 -1.0 2.0
   84    90    39    33   0.11100  1.0 3.0
   84    90    39    40   0.15000  1.0 3.0
   84    90    39    42   0.34400  1.0 1.0
   84    90    39    42   0.09450 -1.0 2.0
   84    90    39    42   0.11100  1.0 3.0
   88    84    90    91   0.09700  1.0 1.0
   88    84    90    91   0.15600 -1.0 2.0
   88    84    90    91  -0.50800  1.0 3.0
   88    84    90    92   0.15000  1.0 3.0
   88    84    90    39   0.09700  1.0 1.0
   88    84    90    39   0.15600 -1.0 2.0
   88    84    90    39  -0.50800  1.0 3.0
   88    95   -98    75   2.00000 -1.0 2.0
   88    95    98    99   3.00000 -1.0 2.0
   89    88    95    98   3.00000 -1.0 2.0
   98    75   -84    88   7.00000 -1.0 2.0
   98    75    84    90   7.00000 -1.0 2.0
   90    84    88    89  -0.64400  1.0 1.0
   90    84    88    89   0.26850 -1.0 2.0
   90    84    88    95  -0.15000  1.0 1.0
   90    84    88    95   0.89550 -1.0 2.0
   90    84    88    95  -0.06900  1.0 3.0
   90    39    42    43   0.15000  1.0 3.0
   90    39    42    46   0.56750  1.0 1.0
   90    39    42    46  -0.07550 -1.0 2.0
   90    39    42    46   0.20000  1.0 3.0
   90    39    42    49   0.86500  1.0 1.0
   90    39    42    49  -0.17500 -1.0 2.0
   90    39    42    49   0.20800  1.0 3.0
   91    90    39    33   0.62750  1.0 1.0
   91    90    39    33  -0.30950 -1.0 2.0
   91    90    39    33   0.27300  1.0 3.0
   91    90    39    40   0.23400  1.0 3.0
   91    90    39    42   0.62750  1.0 1.0
   91    90    39    42  -0.30950 -1.0 2.0
   91    90    39    42   0.27300  1.0 3.0
   92    90    39    33   0.15000  1.0 3.0
   92    90    39    40   0.15000  1.0 3.0
   92    90    39    42   0.15000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.36750  1.0 3.0
   39    33    51    44  -0.95700  1.0 1.0
   39    33    51    44  -0.18200 -1.0 2.0
   39    33    51    44   0.29450  1.0 3.0
   39    33    51    52   0.15000  1.0 3.0
   39    33    51    56   0.56750  1.0 1.0
   39    33    51    56  -0.07550 -1.0 2.0
   39    33    51    56   0.20000  1.0 3.0
   39    42    46    47   0.15000  1.0 3.0
   39    42    46    48   0.15000  1.0 3.0
   39    42    46    53   0.56750  1.0 1.0
   39    42    46    53  -0.07550 -1.0 2.0
   39    42    46    53   0.20000  1.0 3.0
   39    42    49    50  -0.11600  1.0 1.0
   39    42    49    50  -0.09450 -1.0 2.0
   39    42    49    50   0.21250  1.0 3.0
   40    39    42    43   0.15000  1.0 3.0
   40    39    42    46   0.15000  1.0 3.0
   40    39    42    49   0.23400  1.0 3.0
   42    46    53    54   0.15000  1.0 3.0
   42    46    53    55   0.15000  1.0 3.0
   42    46    53    59   0.56750  1.0 1.0
   42    46    53    59  -0.07550 -1.0 2.0
   42    46    53    59   0.20000  1.0 3.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    53   0.15000  1.0 3.0
   43    42    49    50   0.19450  1.0 3.0
   46    42    49    50  -0.11600  1.0 1.0
   46    42    49    50  -0.09450 -1.0 2.0
   46    42    49    50   0.21250  1.0 3.0
   46    53    59    60   0.15000  1.0 3.0
   46    53    59    61   0.15000  1.0 3.0
   46    53    59    64   0.56750  1.0 1.0
   46    53    59    64  -0.07550 -1.0 2.0
   46    53    59    64   0.20000  1.0 3.0
   47    46    53    54   0.15000  1.0 3.0
   47    46    53    55   0.15000  1.0 3.0
   47    46    53    59   0.15000  1.0 3.0
   48    46    53    54   0.15000  1.0 3.0
   48    46    53    55   0.15000  1.0 3.0
   48    46    53    59   0.15000  1.0 3.0
   53    59    64    65   0.15000  1.0 3.0
   53    59    64    66   0.15000  1.0 3.0
   53    59    64    70   0.56750  1.0 1.0
   53    59    64    70  -0.07550 -1.0 2.0
   53    59    64    70   0.20000  1.0 3.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    61   0.15000  1.0 3.0
   54    53    59    64   0.15000  1.0 3.0
   55    53    59    60   0.15000  1.0 3.0
   55    53    59    61   0.15000  1.0 3.0
   55    53    59    64   0.15000  1.0 3.0
   59    64    70    71   0.15000  1.0 3.0
   59    64    70    72   0.15000  1.0 3.0
   59    64    70    76   0.56750  1.0 1.0
   59    64    70    76  -0.07550 -1.0 2.0
   59    64    70    76   0.20000  1.0 3.0
   60    59    64    65   0.15000  1.0 3.0
   60    59    64    66   0.15000  1.0 3.0
   60    59    64    70   0.15000  1.0 3.0
   61    59    64    65   0.15000  1.0 3.0
   61    59    64    66   0.15000  1.0 3.0
   61    59    64    70   0.15000  1.0 3.0
   64    70    76    77   0.15000  1.0 3.0
   64    70    76    78   0.15000  1.0 3.0
   64    70    76    79   0.15000  1.0 3.0
   65    64    70    71   0.15000  1.0 3.0
   65    64    70    72   0.15000  1.0 3.0
   65    64    70    76   0.15000  1.0 3.0
   66    64    70    71   0.15000  1.0 3.0
   66    64    70    72   0.15000  1.0 3.0
   66    64    70    76   0.15000  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    78   0.15000  1.0 3.0
   71    70    76    79   0.15000  1.0 3.0
   72    70    76    77   0.15000  1.0 3.0
   72    70    76    78   0.15000  1.0 3.0
   72    70    76    79   0.15000  1.0 3.0
   49    42    46    47   0.23400  1.0 3.0
   49    42    46    48   0.23400  1.0 3.0
   49    42    46    53   0.86500  1.0 1.0
   49    42    46    53  -0.17500 -1.0 2.0
   49    42    46    53   0.20800  1.0 3.0
   73    62    67    68   0.15000  1.0 3.0
   73    62    67    69   0.15000  1.0 3.0
   73    62    67    75   0.34400  1.0 1.0
   73    62    67    75   0.09450 -1.0 2.0
   73    62    67    75   0.11100  1.0 3.0
   73    80    85    86   0.15000  1.0 3.0
   73    80    85    87   0.15000  1.0 3.0
   73    80    85    93   0.34400  1.0 1.0
   73    80    85    93   0.09450 -1.0 2.0
   73    80    85    93   0.11100  1.0 3.0
   73    80   102   100  -0.25900  1.0 1.0
   73    80   102   100  -0.47000 -1.0 2.0
   73    80   102   100   0.11750  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   102   0.23400  1.0 3.0
   74    73    82    83   0.19450  1.0 3.0
   80    73    82    83  -0.11600  1.0 1.0
   80    73    82    83  -0.09450 -1.0 2.0
   80    73    82    83   0.21250  1.0 3.0
   80    85    93    94   0.00000  1.0 1.0
   80    85    93    96   0.09850  1.0 1.0
   80    85    93    96   0.15250 -1.0 2.0
   80    85    93    96  -0.50650  1.0 3.0
   81    80    85    86   0.15000  1.0 3.0
   81    80    85    87   0.15000  1.0 3.0
   81    80    85    93   0.15000  1.0 3.0
   81    80   102   100   0.08050  1.0 3.0
   85    80   102   100  -0.25900  1.0 1.0
   85    80   102   100  -0.47000 -1.0 2.0
   85    80   102   100   0.11750  1.0 3.0
   85    93    96    97   7.00000 -1.0 2.0
   85    93   -96   100   7.00000 -1.0 2.0
   86    85    93    94   0.33100  1.0 3.0
   86    85    93    96   0.00000  1.0 1.0
   87    85    93    94   0.33100  1.0 3.0
   87    85    93    96   0.00000  1.0 1.0
   93    96   100   101   1.00000 -1.0 2.0
   93    96   100   102  -0.56150  1.0 1.0
   93    96   100   102   2.19150 -1.0 2.0
   94    93    96    97   7.00000 -1.0 2.0
   94    93    96   100   7.00000 -1.0 2.0
   96   100  -102    80   2.00000 -1.0 2.0
   97    96   100   101   0.00000  1.0 1.0
   97    96   100   102   1.63100 -1.0 2.0
  101   100   102    80   3.00000 -1.0 2.0
  102    80    85    86   0.23400  1.0 3.0
  102    80    85    87   0.23400  1.0 3.0
  102    80   -85    93   0.61850  1.0 1.0
  102    80   -85    93  -0.22750 -1.0 2.0
  102    80   -85    93   0.15300  1.0 3.0
   82    73    80    81   0.23400  1.0 3.0
   82    73    80    85   0.86500  1.0 1.0
   82    73    80    85  -0.17500 -1.0 2.0
   82    73    80    85   0.20800  1.0 3.0
   82    73    80   102   3.69350  1.0 1.0
   82    73    80   102  -1.82950 -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
   35    30    34    36  10.50000 -1.0 2.0
   33    41    37    38  10.50000 -1.0 2.0
   41    51    44    45  10.50000 -1.0 2.0
   67    98    75    84   1.10000 -1.0 2.0
   88    90    84    75   1.10000 -1.0 2.0
   84    95    88    89  10.50000 -1.0 2.0
   75    95    98    99  10.50000 -1.0 2.0
   85    94    93    96   1.10000 -1.0 2.0
  100    97    96    93   1.10000 -1.0 2.0
   96   102   100   101  10.50000 -1.0 2.0
END
