* LIGAND DATABASE FILE (OPLS2005)
*
001      76    77    141    215     419
    1     0 S   NP   _N1_     1    28.52193    95.88423   -21.29844
    2     1 S   H    _HN1     2     1.02960    80.56657    30.99464
    3     1 S   H    _H1_     3     1.02833    37.44244   165.86457
    4     1 S   H    _H2_     4     1.02779    92.33535   -77.20551
    5     1 S   CT   _CA1     5     1.50127   146.71752   143.95287
    6     5 S   HC   _HA1     6     1.09576   105.21100    73.17124
    7     5 S   CO3  _C1_     7     1.53773   112.43245   -46.99671
    8     7 S   O2Z  _O11     8     1.26358   115.00122   -42.68897
    9     7 S   O2Z  _O12     9     1.26240   114.92154   136.45493
   10     5 S   CT   _CB1    10     1.53087   107.41434  -168.93468
   11    10 S   HC   HB11    11     1.09827   109.26985   -50.80579
   12    10 S   HC   HB12    12     1.09818   110.42866    65.72328
   13    10 S   CT   _CG1    13     1.53017   112.72066  -171.91638
   14    13 S   HC   HG11    14     1.09593   110.46499   -65.03609
   15    13 S   HC   HG12    15     1.09657   109.95621    54.20251
   16    13 S   C    _CD1    16     1.51823   112.30493   174.50795
   17    16 S   O    _OE1    17     1.22724   123.25403    -0.51472
   18    16 S   N    _N2_    18     1.38657   111.66933   179.74131
   19    18 S   H    _HN2    19     1.01581   119.02454     1.13090
   20    18 S   CT1  _CA2    20     1.46167   123.32783   179.06791
   21    20 S   HC   _HA2    21     1.09740   109.37166    -4.43646
   22    20 S   C    _C2_    22     1.53512   108.54317  -119.97077
   23    22 S   O    _O2_    23     1.23037   122.11778  -146.30537
   24    20 S   CT   _CB2    32     1.53413   111.70381   117.52618
   25    24 S   HC   HB21    33     1.09589   110.10031    56.22912
   26    24 S   HC   HB22    34     1.09409   109.88496   175.10607
   27    22 S   N    _N3_    24     1.38467   113.52302    41.08007
   28    27 S   H    _HN3    25     1.01509   118.95470    -0.93440
   29    24 S   S    _SG2    35     1.82755   111.75644   -64.56717
   30    27 S   CT   _CA3    26     1.45471   123.63222   175.11080
   31    30 S   HC   HA31    27     1.09511   109.49246    19.44153
   32    30 S   HC   HA32    28     1.09507   107.06818   136.48634
   33    29 S   CT   _C6_    36     1.84852    99.66198   179.02141
   34    33 S   HC   _H4_    37     1.09575   105.99201   -40.70850
   35    30 S   CO3  _C3_    29     1.52914   112.89365  -104.20207
   36    35 S   O2Z  _O31    30     1.26421   115.31491   -46.55739
   37    35 S   O2Z  _O32    31     1.26341   115.03743   134.29128
   38    33 S   CT   _C7_    38     1.54148   111.15483    78.80745
   39    38 S   HC   _H5_    39     1.09532   110.88568   -43.53155
   40    38 S   CT   _C8_    40     1.53274   113.39248    80.01266
   41    40 S   HC   _H6_    41     1.09679   110.70491   167.75813
   42    38 S   OH   _O39    75     1.43111   108.98493  -159.93978
   43    42 S   HO   _H20    76     0.97300   107.62086    61.87852
   44    40 S   CO   _C9_    42     1.53509   111.26016    46.81438
   45    44 S   HC   _H7_    43     1.09336   108.71360    65.52054
   46    40 S   OH   _O38    73     1.42898   110.12986   -74.36354
   47    46 S   HO   _H19    74     0.97219   107.71020   -59.17383
   48    44 S   OS   _O33    44     1.42650   109.88179   -55.11652
   49    44 S   OS   _O34    52     1.43269   107.24193  -177.78565
   50    33 S   CT   _C5_    45     1.54796   108.51767  -156.97148
   51    50 S   HC   _H3_    46     1.09844   108.36525    38.55898
   52    49 S   CO   _C10    53     1.43546   117.27590   179.53396
   53    50 S   CT   _C4_    47     1.53618   113.84524   155.24261
   54    53 S   HC   _H11    48     1.09578   109.83064   177.74779
   55    53 S   HC   _H12    49     1.09257   112.58805    58.38505
   56    52 S   CT   _C11    54     1.53528   107.84902  -177.09296
   57    56 S   HC   _H8_    55     1.09725   111.73593  -166.84447
   58    52 S   CT   _C15    69     1.53364   113.60407    57.10806
   59    58 S   Cl   Cl2_    70     1.77831   113.14523    58.23298
   60    58 S   HC   _H17    71     1.09420   111.50932   -63.22502
   61    58 S   HC   _H18    72     1.09573   110.50774   179.06414
   62    53 S   OH   _O40    50     1.42068   110.09935   -62.61224
   63    62 S   HO   _H21    51     0.97264   107.10843  -177.74736
   64    56 S   CT   _C12    56     1.51747   101.52003    76.00296
   65    64 S   HC   _H9_    57     1.09611   111.01449   -82.78874
   66    56 S   OH   _O37    67     1.41647   114.28100   -43.45514
   67    66 S   HO   _H16    68     0.97261   107.64785   -54.12511
   68    64 S   CT   _C13    58     1.52835   102.25533    37.39130
   69    68 S   HC   _H10    59     1.09672   111.33645    95.70349
   70    64 S   OH   _O36    65     1.41960   111.77012   157.32277
   71    70 S   HO   _H15    66     0.97213   108.53296   -55.73663
   72    52 S   OS   _O35    60     1.44566   111.35428   -65.31310
   73    68 S   CT   _C14    61     1.52572   113.84538  -140.10082
   74    73 S   Cl   Cl1_    62     1.77536   111.93242   -66.86418
   75    73 S   HC   _H13    63     1.09510   110.38218   172.83226
   76    73 S   HC   _H14    64     1.09502   111.31648    54.41333
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   8   2   1   1  14   7  11   7   4   1  12   5   3   1   8
  12   6   4  15   4   3   2  15   8   7   3   2   1   1   1  12
   7   4   1   8   6   3   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    48    50    51    53    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    48    50    51    53    54    55    62    46    42    43  
   38    39    40    48    50    51    53    42  
   36    37  
   37  
    0  
   39    40    41    44    45    48    50    51    53    49    46    47    42    43  
   40    41    44    50    46    42    43  
   41    44    45    48    50    49    52    46    47    42    43  
   44    45    48    49    46    47    42  
   43    44    46    50  
    0  
   45    48    50    51    53    49    52    56    72    58    46    47  
   48    50    49    52    46  
   47    48    49  
    0  
   50    51    53    54    55    62    49    52  
   52    56    57    64    68    72    66    58    59    60    61    50  
   51    53    54    55    62    63  
   53    54    55    62  
   56    57    64    65    68    69    72    73    70    66    67    58    59    60    61  
   54    55    62    63  
   55    62    63  
   62    63  
   57    64    65    68    69    72    73    70    71    66    67    58    59    60    61  
   64    65    68    72    70    66    67    58  
   59    60    61    64    66    68    72  
   60    61    72  
   61    72  
   72  
   63  
    0  
   65    68    69    72    73    74    75    76    70    71    66    67  
   68    69    72    73    70    71    66  
   67    68    70    72  
    0  
   69    72    73    74    75    76    70    71  
   72    73    74    75    76    70  
   71    72    73  
    0  
   73    74    75    76  
   74    75    76  
   75    76  
   76  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   49   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.400000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660   0.145000   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   60   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   73   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   74   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   75   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    50   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    44   250.000  1.527
   40    46   320.000  1.410
   44    45   340.000  1.090
   44    48   320.000  1.380
   44    49   320.000  1.380
   48    50   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    62   320.000  1.410
   62    63   553.000  0.945
   49    52   320.000  1.380
   52    56   250.000  1.527
   52    72   320.000  1.380
   52    58   250.000  1.527
   56    57   340.000  1.090
   56    64   268.000  1.529
   56    66   320.000  1.410
   64    65   340.000  1.090
   64    68   268.000  1.529
   64    70   320.000  1.410
   68    69   340.000  1.090
   68    72   320.000  1.410
   68    73   268.000  1.529
   73    74   245.000  1.781
   73    75   340.000  1.090
   73    76   340.000  1.090
   70    71   553.000  0.945
   66    67   553.000  0.945
   58    59   245.000  1.781
   58    60   340.000  1.090
   58    61   340.000  1.090
   46    47   553.000  0.945
   42    43   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    50    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    50.00000  109.50000
   33    50    48    50.00000  109.50000
   33    50    51    37.50000  110.70000
   33    50    53    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    44    75.00000  109.43000
   38    40    46    50.00000  109.50000
   38    42    43    55.00000  108.50000
   40    38    39    37.50000  110.70000
   40    44    45    45.00000  112.01100
   40    44    48    90.00000  108.56700
   40    44    49    90.00000  108.56700
   40    46    47    55.00000  108.50000
   44    40    41    45.00000  108.72000
   44    48    50    60.00000  109.50000
   44    49    52   100.00000  109.58800
   48    44    45    35.00000  109.50000
   48    50    51    35.00000  109.50000
   48    50    53    50.00000  109.50000
   50    33    34    37.50000  110.70000
   50    33    38    58.35000  112.70000
   50    53    54    37.50000  110.70000
   50    53    55    37.50000  110.70000
   50    53    62    50.00000  109.50000
   53    50    51    37.50000  110.70000
   53    62    63    55.00000  108.50000
   55    53    54    33.00000  107.80000
   62    53    54    35.00000  109.50000
   62    53    55    35.00000  109.50000
   49    44    45    35.00000  109.50000
   49    44    48    92.60000  111.55000
   49    52    56    90.00000  108.56700
   49    52    72    92.60000  111.55000
   49    52    58    90.00000  108.56700
   52    56    57    45.00000  108.72000
   52    56    64    75.00000  109.43000
   52    56    66    90.00000  111.58700
   52    72    68    60.00000  109.50000
   52    58    59    75.00000  108.76400
   52    58    60    45.00000  108.72000
   52    58    61    45.00000  108.72000
   56    64    65    37.50000  110.70000
   56    64    68    58.35000  112.70000
   56    64    70    50.00000  109.50000
   56    66    67    55.00000  108.50000
   64    56    57    37.50000  110.70000
   64    68    69    37.50000  110.70000
   64    68    72    50.00000  109.50000
   64    68    73    58.35000  112.70000
   64    70    71    55.00000  108.50000
   68    64    65    37.50000  110.70000
   68    73    74    69.00000  109.80000
   68    73    75    37.50000  110.70000
   68    73    76    37.50000  110.70000
   72    52    56    90.00000  108.56700
   72    68    69    35.00000  109.50000
   73    68    69    37.50000  110.70000
   73    68    72    50.00000  109.50000
   75    73    74    51.00000  107.60000
   76    73    74    51.00000  107.60000
   76    73    75    33.00000  107.80000
   70    64    65    35.00000  109.50000
   70    64    68    50.00000  109.50000
   66    56    57    35.00000  109.50000
   66    56    64    50.00000  109.50000
   58    52    56    65.00000  112.71400
   58    52    72    90.00000  108.56700
   60    58    59    51.00000  107.60000
   61    58    59    51.00000  107.60000
   61    58    60    33.00000  107.80000
   46    40    41    35.00000  109.50000
   46    40    44    90.00000  111.58700
   42    38    39    35.00000  109.50000
   42    38    40    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    50    48   0.56750  1.0 1.0
   29    33    50    48  -0.07550 -1.0 2.0
   29    33    50    48   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    53   0.44750  1.0 1.0
   29    33    50    53  -0.17800 -1.0 2.0
   29    33    50    53   0.20200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    44   3.97050  1.0 1.0
   33    38    40    46   0.86500  1.0 1.0
   33    38    40    46  -0.17500 -1.0 2.0
   33    38    40    46   0.20800  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  1.0 3.0
   33    50    53    54   0.15000  1.0 3.0
   33    50    53    55   0.15000  1.0 3.0
   33    50    53    62   0.86500  1.0 1.0
   33    50    53    62  -0.17500 -1.0 2.0
   33    50    53    62   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    50    48   0.23400  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    53   0.15000  1.0 3.0
   38    33    50    48   0.62750  1.0 1.0
   38    33    50    48  -0.30950 -1.0 2.0
   38    33    50    48   0.27300  1.0 3.0
   38    33    50    51   0.15000  1.0 3.0
   38    33    50    53   0.56750  1.0 1.0
   38    33    50    53  -0.07550 -1.0 2.0
   38    33    50    53   0.20000  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40   -44    48   0.62750  1.0 1.0
   38    40   -44    48  -0.30950 -1.0 2.0
   38    40   -44    48   0.27300  1.0 3.0
   38    40    44    49   0.62750  1.0 1.0
   38    40    44    49  -0.30950 -1.0 2.0
   38    40    44    49   0.27300  1.0 3.0
   38    40    46    47  -0.11600  1.0 1.0
   38    40    46    47  -0.09450 -1.0 2.0
   38    40    46    47   0.21250  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    44   0.15000  1.0 3.0
   39    38    40    46   0.23400  1.0 3.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43  -0.11600  1.0 1.0
   40    38    42    43  -0.09450 -1.0 2.0
   40    38    42    43   0.21250  1.0 3.0
   40    44    48    50   0.06250  1.0 1.0
   40    44    48    50  -0.01100 -1.0 2.0
   40    44    48    50   0.28050  1.0 3.0
   40    44    49    52   0.06250  1.0 1.0
   40    44    49    52  -0.01100 -1.0 2.0
   40    44    49    52   0.28050  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    48   0.23400  1.0 3.0
   41    40    44    49   0.23400  1.0 3.0
   41    40    46    47   0.19450  1.0 3.0
   44    40    46    47  -0.11600  1.0 1.0
   44    40    46    47  -0.09450 -1.0 2.0
   44    40    46    47   0.21250  1.0 3.0
   44    48   -50    33   0.06250  1.0 1.0
   44    48   -50    33  -0.01100 -1.0 2.0
   44    48   -50    33   0.28050  1.0 3.0
   44    48    50    51   0.37050  1.0 3.0
   44    48    50    53   0.06250  1.0 1.0
   44    48    50    53  -0.01100 -1.0 2.0
   44    48    50    53   0.28050  1.0 3.0
   44    49    52    56   0.06250  1.0 1.0
   44    49    52    56  -0.01100 -1.0 2.0
   44    49    52    56   0.28050  1.0 3.0
   44    49    52    72  -0.53350  1.0 1.0
   44    49    52    72  -0.78350 -1.0 2.0
   44    49    52    72   0.33750  1.0 3.0
   44    49    52    58   0.06250  1.0 1.0
   44    49    52    58  -0.01100 -1.0 2.0
   44    49    52    58   0.28050  1.0 3.0
   45    44    48    50   0.37050  1.0 3.0
   45    44    49    52   0.37050  1.0 3.0
   48    44    49    52  -0.53350  1.0 1.0
   48    44    49    52  -0.78350 -1.0 2.0
   48    44    49    52   0.33750  1.0 3.0
   48    50    53    54   0.23400  1.0 3.0
   48    50    53    55   0.23400  1.0 3.0
   48    50    53    62   3.69350  1.0 1.0
   48    50    53    62  -1.82950 -1.0 2.0
   50    33    38    39   0.15000  1.0 3.0
   50    33   -38    40   0.56750  1.0 1.0
   50    33   -38    40  -0.07550 -1.0 2.0
   50    33   -38    40   0.20000  1.0 3.0
   50    33    38    42   0.86500  1.0 1.0
   50    33    38    42  -0.17500 -1.0 2.0
   50    33    38    42   0.20800  1.0 3.0
   50    53    62    63  -0.11600  1.0 1.0
   50    53    62    63  -0.09450 -1.0 2.0
   50    53    62    63   0.21250  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    55   0.15000  1.0 3.0
   51    50    53    62   0.23400  1.0 3.0
   54    53    62    63   0.19450  1.0 3.0
   55    53    62    63   0.19450  1.0 3.0
   49    44    48    50  -0.81800  1.0 1.0
   49    52    56    57   0.23400  1.0 3.0
   49    52    56    64   0.62750  1.0 1.0
   49    52    56    64  -0.30950 -1.0 2.0
   49    52    56    64   0.27300  1.0 3.0
   49    52    56    66   3.69350  1.0 1.0
   49    52    56    66  -1.82950 -1.0 2.0
   49    52    72    68  -0.53350  1.0 1.0
   49    52    72    68  -0.78350 -1.0 2.0
   49    52    72    68   0.33750  1.0 3.0
   49    52    58    59   0.56750  1.0 1.0
   49    52    58    59  -0.07550 -1.0 2.0
   49    52    58    59   0.20000  1.0 3.0
   49    52    58    60   0.23400  1.0 3.0
   49    52    58    61   0.23400  1.0 3.0
   52    56    64    65   0.15000  1.0 3.0
   52    56   -64    68   3.97050  1.0 1.0
   52    56    64    70   0.86500  1.0 1.0
   52    56    64    70  -0.17500 -1.0 2.0
   52    56    64    70   0.20800  1.0 3.0
   52    56    66    67  -0.11600  1.0 1.0
   52    56    66    67  -0.09450 -1.0 2.0
   52    56    66    67   0.21250  1.0 3.0
   56    52   -72    68   0.06250  1.0 1.0
   56    52   -72    68  -0.01100 -1.0 2.0
   56    52   -72    68   0.28050  1.0 3.0
   56    52    58    59   0.35600  1.0 1.0
   56    52    58    59  -0.14650 -1.0 2.0
   56    52    58    59   0.33350  1.0 3.0
   56    52    58    60   0.15000  1.0 3.0
   56    52    58    61   0.15000  1.0 3.0
   56    64    68    69   0.15000  1.0 3.0
   56    64   -68    72   0.62750  1.0 1.0
   56    64   -68    72  -0.30950 -1.0 2.0
   56    64   -68    72   0.27300  1.0 3.0
   56    64    68    73   0.56750  1.0 1.0
   56    64    68    73  -0.07550 -1.0 2.0
   56    64    68    73   0.20000  1.0 3.0
   56    64    70    71  -0.11600  1.0 1.0
   56    64    70    71  -0.09450 -1.0 2.0
   56    64    70    71   0.21250  1.0 3.0
   57    56    64    65   0.15000  1.0 3.0
   57    56    64    68   0.15000  1.0 3.0
   57    56    64    70   0.23400  1.0 3.0
   57    56    66    67   0.19450  1.0 3.0
   64    56    66    67  -0.11600  1.0 1.0
   64    56    66    67  -0.09450 -1.0 2.0
   64    56    66    67   0.21250  1.0 3.0
   64    68   -72    52   0.06250  1.0 1.0
   64    68   -72    52  -0.01100 -1.0 2.0
   64    68   -72    52   0.28050  1.0 3.0
   64    68    73    74   0.35600  1.0 1.0
   64    68    73    74  -0.14650 -1.0 2.0
   64    68    73    74   0.33350  1.0 3.0
   64    68    73    75   0.15000  1.0 3.0
   64    68    73    76   0.15000  1.0 3.0
   65    64    68    69   0.15000  1.0 3.0
   65    64    68    72   0.23400  1.0 3.0
   65    64    68    73   0.15000  1.0 3.0
   65    64    70    71   0.19450  1.0 3.0
   68    64    70    71  -0.11600  1.0 1.0
   68    64    70    71  -0.09450 -1.0 2.0
   68    64    70    71   0.21250  1.0 3.0
   69    68    72    52   0.37050  1.0 3.0
   69    68    73    74   0.27000  1.0 3.0
   69    68    73    75   0.15000  1.0 3.0
   69    68    73    76   0.15000  1.0 3.0
   72    52    56    57   0.23400  1.0 3.0
   72    52   -56    64   0.62750  1.0 1.0
   72    52   -56    64  -0.30950 -1.0 2.0
   72    52   -56    64   0.27300  1.0 3.0
   72    52    56    66   3.69350  1.0 1.0
   72    52    56    66  -1.82950 -1.0 2.0
   72    52    58    59   0.56750  1.0 1.0
   72    52    58    59  -0.07550 -1.0 2.0
   72    52    58    59   0.20000  1.0 3.0
   72    52    58    60   0.23400  1.0 3.0
   72    52    58    61   0.23400  1.0 3.0
   72    68    73    74   0.56750  1.0 1.0
   72    68    73    74  -0.07550 -1.0 2.0
   72    68    73    74   0.20000  1.0 3.0
   72    68    73    75   0.23400  1.0 3.0
   72    68    73    76   0.23400  1.0 3.0
   73    68    72    52   0.06250  1.0 1.0
   73    68    72    52  -0.01100 -1.0 2.0
   73    68    72    52   0.28050  1.0 3.0
   70    64    68    69   0.23400  1.0 3.0
   70    64    68    72   3.69350  1.0 1.0
   70    64    68    72  -1.82950 -1.0 2.0
   70    64    68    73   0.86500  1.0 1.0
   70    64    68    73  -0.17500 -1.0 2.0
   70    64    68    73   0.20800  1.0 3.0
   66    56    64    65   0.23400  1.0 3.0
   66    56    64    68   0.86500  1.0 1.0
   66    56    64    68  -0.17500 -1.0 2.0
   66    56    64    68   0.20800  1.0 3.0
   66    56    64    70   3.75450  1.0 1.0
   58    52    56    57   0.15000  1.0 3.0
   58    52    56    64   0.56750  1.0 1.0
   58    52    56    64  -0.07550 -1.0 2.0
   58    52    56    64   0.20000  1.0 3.0
   58    52    56    66   0.86500  1.0 1.0
   58    52    56    66  -0.17500 -1.0 2.0
   58    52    56    66   0.20800  1.0 3.0
   58    52    72    68   0.06250  1.0 1.0
   58    52    72    68  -0.01100 -1.0 2.0
   58    52    72    68   0.28050  1.0 3.0
   46    40    44    45   0.23400  1.0 3.0
   46    40    44    48   3.69350  1.0 1.0
   46    40    44    48  -1.82950 -1.0 2.0
   46    40    44    49   3.69350  1.0 1.0
   46    40    44    49  -1.82950 -1.0 2.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    44   0.86500  1.0 1.0
   42    38    40    44  -0.17500 -1.0 2.0
   42    38    40    44   0.20800  1.0 3.0
   42    38    40    46   3.75450  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
END
