* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    135    207     387
    1     0 S   NP   _N1_     1    28.64684    99.10139   -19.61548
    2     1 S   H    _HN1     2     1.02957    58.04538    -3.99366
    3     1 S   H    _H1_     3     1.02836    58.47790   138.01242
    4     1 S   H    _H2_     4     1.02777    93.78116  -113.28778
    5     1 S   CT   _CA1     5     1.50156   153.97275    66.03501
    6     5 S   HC   _HA1     6     1.09578   105.17286   119.28970
    7     5 S   CO3  _C1_     7     1.53755   112.31444    -0.80915
    8     7 S   O2Z  _O11     8     1.26366   114.98119   -44.23700
    9     7 S   O2Z  _O12     9     1.26229   114.91595   134.64817
   10     5 S   CT   _CB1    10     1.53079   107.39692  -122.87458
   11    10 S   HC   HB11    11     1.09832   109.22220   -50.50777
   12    10 S   HC   HB12    12     1.09813   110.47654    66.00784
   13    10 S   CT   _CG1    13     1.53048   112.74154  -171.56820
   14    13 S   HC   HG11    14     1.09590   110.54545   -66.46626
   15    13 S   HC   HG12    15     1.09663   109.86921    52.75750
   16    13 S   C    _CD1    16     1.51867   112.19381   173.04780
   17    16 S   O    _OE1    17     1.22776   123.25116     3.76536
   18    16 S   N    _N2_    18     1.38563   111.84201  -176.10544
   19    18 S   H    _HN2    19     1.01573   119.11948     3.01766
   20    18 S   CT1  _CA2    20     1.45819   122.72074   177.11025
   21    20 S   HC   _HA2    21     1.09736   108.85339    27.09414
   22    20 S   C    _C2_    22     1.52980   107.05248   -89.92149
   23    22 S   O    _O2_    23     1.22973   123.10769   -26.91593
   24    20 S   CT   _CB2    32     1.53250   112.30194   150.42482
   25    24 S   HC   HB21    33     1.09448   109.82564    54.67503
   26    24 S   HC   HB22    34     1.09465   109.74042   173.15441
   27    22 S   N    _N3_    24     1.38508   112.50698   155.86613
   28    27 S   H    _HN3    25     1.01653   120.34246    -2.44769
   29    24 S   S    _SG2    35     1.82701   110.88531   -67.62450
   30    27 S   CT   _CA3    26     1.45351   122.52843   178.48742
   31    30 S   HC   HA31    27     1.09568   107.85175   -54.81868
   32    30 S   HC   HA32    28     1.09561   107.58542    61.53735
   33    29 S   CT   _C9_    36     1.86695   101.77681   161.09526
   34    30 S   CO3  _C3_    29     1.52900   114.27680  -176.75961
   35    34 S   O2Z  _O31    30     1.26342   116.04537    -0.55602
   36    34 S   O2Z  _O32    31     1.26432   114.42019   179.41116
   37    33 S   CM   _C10    37     1.52350   106.58083   164.93838
   38    33 S   S    _S1_    59     1.83777   108.92662   -71.46667
   39    37 S   N4   _N4_    38     1.35823   107.76222   -97.89722
   40    37 S   CMA  _C11    56     1.51196   126.17740    91.50420
   41    40 S   OM   _O33    57     1.26311   121.30730   112.75164
   42    40 S   OM   _O34    58     1.26231   120.45719   -67.00335
   43    38 S   CT   _C13    60     1.82787   102.39107   177.73652
   44    43 S   HC   _H11    61     1.09293   111.20269    27.59601
   45    43 S   HC   _H12    62     1.09454   107.91818   -90.84574
   46    39 S   C4   _C12    39     1.34410   138.00459  -140.64880
   47    46 S   O    _O35    40     1.20851   134.60093   -34.14857
   48    39 S   C4T  _C7_    43     1.45140   114.57961     0.36369
   49    48 S   HC   _H5_    44     1.09922   111.23903    97.88210
   50    43 S   CT   _C14    63     1.52593   110.65417   149.63506
   51    50 S   HC   _H13    64     1.09603   109.48945   174.55813
   52    50 S   HC   _H14    65     1.09641   111.74730    56.12039
   53    46 S   C4T  _C6_    41     1.56829    89.42389   140.18122
   54    53 S   HC   _H4_    42     1.09893   111.82864   115.63855
   55    33 S   CT   _C8_    45     1.56234   112.33820    54.86603
   56    55 S   HC   _H9_    46     1.09273   114.29244   -39.82937
   57    55 S   HC   _H10    47     1.09421   111.87604  -160.61495
   58    50 S   N    _N5_    66     1.45127   112.60047   -66.97898
   59    58 S   H    _H15    67     1.02051   118.15089   -14.86768
   60    53 S   CT   _C5_    48     1.52213   115.28737  -114.76113
   61    60 S   HC   _H3_    49     1.09554   111.23644    45.77216
   62    58 S   C    _C15    68     1.38090   122.64770   167.67309
   63    62 S   O    _O36    69     1.22813   125.42639     0.23490
   64    60 S   CT   _C4_    50     1.52199   110.79677   -76.65229
   65    64 S   HC   _H6_    51     1.09581   110.99061   -59.29480
   66    64 S   HC   _H7_    52     1.09526   110.52099  -177.54664
   67    64 S   HC   _H8_    53     1.09383   111.62001    61.59674
   68    60 S   OH   _O37    54     1.42541   107.99287   164.21130
   69    68 S   HO   _H19    55     0.97254   107.47913  -179.46845
   70    62 S   CT   _C16    70     1.50454   112.36758   179.71401
   71    70 S   HC   _H16    71     1.09346   109.71793   173.14316
   72    70 S   HC   _H17    72     1.09350   109.62024   -67.03300
   73    70 S   HC   _H18    73     1.09378   110.07617    53.47240
  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
  17   2   1   1  14  13  13   5   1   1   9   5   4  10   4  10
   6   7   4   3  12   5   3   1   1   7   3   7   6   5   4   5
   3   2   1   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    55    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    48    55    56    57    40    38    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    46    53    48    49    55    56    57    40    41    42    38    43    44    45    50  
   35    36  
   36  
    0  
   39    46    47    53    48    49    55    56    57    40    41    42    38    43  
   43    44    45    50    51    52    58    39    40    48    55    56    57  
   46    47    53    54    48    49    55    56    57    60    40    41    42  
   41    42    46    48    55  
   42  
    0  
   44    45    50    51    52    58    59    62    55  
   45    50    51    52    58  
   50    51    52    58  
   47    53    54    48    49    55    60    61    64    68  
   53    54    48    60  
   49    55    56    57    60    61    64    68    53    54  
   55    56    57    60    53    54  
   51    52    58    59    62    63    70  
   52    58    59    62  
   58    59    62  
   54    55    56    57    60    61    64    65    66    67    68    69  
   55    60    61    64    68  
   56    57    60  
   57  
    0  
   59    62    63    70    71    72    73  
   62    63    70  
   61    64    65    66    67    68    69  
   64    65    66    67    68    69  
   63    70    71    72    73  
   70    71    72    73  
   65    66    67    68    69  
   66    67    68  
   67    68  
   68  
   69  
    0  
   71    72    73  
   72    73  
   73  
    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   0.335000   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   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   39   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   48   3.5000   0.0660   0.003700   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.061200   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   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   59   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   60   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   64   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    55   268.000  1.529
   33    38   222.000  1.810
   37    39   400.000  1.384
   37    40   465.000  1.376
   39    46   440.000  1.369
   39    48   305.000  1.456
   46    47   930.000  1.212
   46    53   250.000  1.540
   53    54   340.000  1.090
   53    48   268.000  1.529
   53    60   260.000  1.519
   48    49   340.000  1.090
   48    55   260.000  1.519
   55    56   340.000  1.090
   55    57   340.000  1.090
   60    61   340.000  1.090
   60    64   268.000  1.529
   60    68   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   553.000  0.945
   40    41   745.000  1.250
   40    42   745.000  1.250
   38    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    58   337.000  1.449
   58    59   434.000  1.010
   58    62   490.000  1.335
   62    63   570.000  1.229
   62    70   317.000  1.522
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    55    75.00000  111.63000
   29    33    38    75.00000  118.28000
   33    37    39    70.00000  113.82800
   33    37    40    70.00000  124.00000
   33    55    48    70.00000  112.98000
   33    55    56    37.50000  110.70000
   33    55    57    37.50000  110.70000
   33    38    43    62.00000   98.90000
   37    39    46    50.00000  132.10000
   37    39    48    50.00000  132.70000
   37    40    41    65.00000  137.10300
   37    40    42    65.00000  137.10300
   39    46    47    75.00000  131.60000
   39    46    53    95.00000   92.72400
   39    48    53   105.00000   87.49700
   39    48    49    50.00000  112.01000
   39    48    55    80.00000  110.05700
   46    53    54    40.00000  113.37500
   46    53    48   100.00000   86.36000
   46    53    60    63.00000  111.10000
   53    46    47    60.00000  136.58000
   53    48    49    37.50000  110.70000
   53    48    55    65.00000  119.52000
   53    60    61    45.00000  111.22300
   53    60    64    70.00000  112.98000
   53    60    68    50.00000  109.50000
   48    39    46   100.00000   93.00000
   48    53    54    37.50000  110.70000
   48    55    56    45.00000  111.22300
   48    55    57    45.00000  111.22300
   55    33    37    70.00000  112.02700
   55    48    49    45.00000  112.72800
   57    55    56    33.00000  107.80000
   60    53    54    45.00000  112.72800
   60    53    48    65.00000  119.52000
   60    64    65    37.50000  110.70000
   60    64    66    37.50000  110.70000
   60    64    67    37.50000  110.70000
   60    68    69    55.00000  108.50000
   64    60    61    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    60    61    35.00000  109.50000
   68    60    64    50.00000  109.50000
   40    37    39    75.00000  120.83300
   42    40    41    65.00000  121.00000
   38    33    37    75.00000  112.20000
   38    33    55    75.00000  111.63000
   38    43    44    35.00000  109.50000
   38    43    45    35.00000  109.50000
   38    43    50    75.00000  111.63000
   43    50    51    37.50000  110.70000
   43    50    52    37.50000  110.70000
   43    50    58    70.00000  110.72300
   45    43    44    33.00000  107.80000
   50    43    44    37.50000  110.70000
   50    43    45    37.50000  110.70000
   50    58    59    38.00000  118.40000
   50    58    62    50.00000  121.90000
   52    50    51    33.00000  107.80000
   58    50    51    35.00000  109.50000
   58    50    52    35.00000  109.50000
   58    62    63    80.00000  122.90000
   58    62    70    70.00000  116.60000
   62    58    59    35.00000  119.80000
   62    70    71    35.00000  109.50000
   62    70    72    35.00000  109.50000
   62    70    73    35.00000  109.50000
   70    62    63    80.00000  120.40000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   0.21350  1.0 3.0
   24    29    33    38   0.08500  1.0 1.0
   24    29    33    38  -0.53150 -1.0 2.0
   24    29    33    38   0.48050  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    39   0.09700  1.0 1.0
   29    33    37    39   0.15600 -1.0 2.0
   29    33    37    39  -0.50800  1.0 3.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    55    48   0.44750  1.0 1.0
   29    33    55    48  -0.17800 -1.0 2.0
   29    33    55    48   0.20200  1.0 3.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   29    33    38    43   0.08500  1.0 1.0
   29    33    38    43  -0.53150 -1.0 2.0
   29    33    38    43   0.48050  1.0 3.0
   33    37    39    46   0.00000  1.0 1.0
   33    37   -39    48   0.00000  1.0 1.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    42   7.00000 -1.0 2.0
   33    38    43    44   0.32350  1.0 3.0
   33    38    43    45   0.32350  1.0 3.0
   33    38    43    50   0.01700  1.0 1.0
   33    38    43    50  -0.23550 -1.0 2.0
   33    38    43    50   0.21350  1.0 3.0
   37    33   -55    48   0.34400  1.0 1.0
   37    33   -55    48   0.09450 -1.0 2.0
   37    33   -55    48   0.11100  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    33    38    43  -0.62250  1.0 1.0
   37    33    38    43  -0.38450 -1.0 2.0
   37    33    38    43   0.81900  1.0 3.0
   37    39    46    47   3.00000 -1.0 2.0
   37    39    46    53   3.00000 -1.0 2.0
   37    39   -48    53   0.00000  1.0 1.0
   37    39    48    49   0.00000  1.0 1.0
   37    39   -48    55   0.00000  1.0 1.0
   39    37    40    41   7.00000 -1.0 2.0
   39    37    40    42   7.00000 -1.0 2.0
   39    46    53    54   0.00000  1.0 1.0
   39    46   -53    48   3.00000 -1.0 2.0
   39    46    53    60   1.39750  1.0 1.0
   39    46    53    60  -0.07950 -1.0 2.0
   39    46    53    60  -0.18750  1.0 3.0
   39    48   -55    33   0.43900  1.0 1.0
   39    48   -55    33   0.49100 -1.0 2.0
   39    48   -55    33   0.28400  1.0 3.0
   39    48    55    56   0.15000  1.0 3.0
   39    48    55    57   0.15000  1.0 3.0
   46    39   -48    53   0.00000  1.0 1.0
   46    39    48    49   0.00000  1.0 1.0
   46    39    48    55   0.00000  1.0 1.0
   46    53   -48    39   3.00000 -1.0 2.0
   46    53   -48    49   0.15000  1.0 3.0
   46    53   -48    55  -0.95700  1.0 1.0
   46    53   -48    55  -0.18200 -1.0 2.0
   46    53   -48    55   0.29450  1.0 3.0
   46    53    60    61  -0.11250  1.0 3.0
   46    53    60    64  -0.95700  1.0 1.0
   46    53    60    64  -0.18200 -1.0 2.0
   46    53    60    64   0.29450  1.0 3.0
   46    53    60    68  -0.09450  1.0 1.0
   46    53    60    68  -1.12950 -1.0 2.0
   46    53    60    68   0.54000  1.0 3.0
   47    46    53    54   0.00000  1.0 1.0
   47    46    53    48  -0.11250  1.0 1.0
   47    46    53    48   0.11400 -1.0 2.0
   47    46    53    48  -0.28950  1.0 3.0
   47    46    53    60   0.30150 -1.0 2.0
   53    48    55    33   0.04050  1.0 1.0
   53    48    55    33   0.63700 -1.0 2.0
   53    48    55    33   0.17650  1.0 3.0
   53    48    55    56   0.00000  1.0 1.0
   53    48    55    57   0.00000  1.0 1.0
   53    60    64    65   0.15000  1.0 3.0
   53    60    64    66   0.15000  1.0 3.0
   53    60    64    67   0.15000  1.0 3.0
   53    60    68    69  -0.11600  1.0 1.0
   53    60    68    69  -0.09450 -1.0 2.0
   53    60    68    69   0.21250  1.0 3.0
   54    53   -48    39   0.15000  1.0 3.0
   54    53    48    49   0.15000  1.0 3.0
   54    53    48    55   0.15000  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    64   0.15000  1.0 3.0
   54    53    60    68   0.23400  1.0 3.0
   48    39   -46    47   3.00000 -1.0 2.0
   48    39   -46    53   3.00000 -1.0 2.0
   48    53    60    61   0.00000  1.0 1.0
   48    53    60    64   0.04050  1.0 1.0
   48    53    60    64   0.63700 -1.0 2.0
   48    53    60    64   0.17650  1.0 3.0
   48    53    60    68   0.86500  1.0 1.0
   48    53    60    68  -0.17500 -1.0 2.0
   48    53    60    68   0.20800  1.0 3.0
   49    48    55    33   0.15000  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   55    33   -37    39  -0.93550  1.0 1.0
   55    33   -37    39   0.38900 -1.0 2.0
   55    33   -37    39   0.16950  1.0 3.0
   55    33    37    40   0.09850  1.0 1.0
   55    33    37    40   0.15250 -1.0 2.0
   55    33    37    40  -0.50650  1.0 3.0
   55    33    38    43   0.01700  1.0 1.0
   55    33    38    43  -0.23550 -1.0 2.0
   55    33    38    43   0.21350  1.0 3.0
   60    53   -48    39   0.43900  1.0 1.0
   60    53   -48    39   0.49100 -1.0 2.0
   60    53   -48    39   0.28400  1.0 3.0
   60    53    48    49   0.15000  1.0 3.0
   60    53    48    55   0.56750  1.0 1.0
   60    53    48    55  -0.07550 -1.0 2.0
   60    53    48    55   0.20000  1.0 3.0
   61    60    64    65   0.15000  1.0 3.0
   61    60    64    66   0.15000  1.0 3.0
   61    60    64    67   0.15000  1.0 3.0
   61    60    68    69   0.19450  1.0 3.0
   64    60    68    69  -0.11600  1.0 1.0
   64    60    68    69  -0.09450 -1.0 2.0
   64    60    68    69   0.21250  1.0 3.0
   68    60    64    65   0.23400  1.0 3.0
   68    60    64    66   0.23400  1.0 3.0
   68    60    64    67   0.23400  1.0 3.0
   40    37    39    46   0.00000  1.0 1.0
   40    37    39    48   0.00000  1.0 1.0
   38    33    37    39   0.09700  1.0 1.0
   38    33    37    39   0.15600 -1.0 2.0
   38    33    37    39  -0.50800  1.0 3.0
   38    33    37    40   0.42700  1.0 1.0
   38    33    37    40  -0.70350 -1.0 2.0
   38    33    37    40  -0.43150  1.0 3.0
   38    33    55    48   0.44750  1.0 1.0
   38    33    55    48  -0.17800 -1.0 2.0
   38    33    55    48   0.20200  1.0 3.0
   38    33    55    56   0.15000  1.0 3.0
   38    33    55    57   0.15000  1.0 3.0
   38    43    50    51   0.15000  1.0 3.0
   38    43    50    52   0.15000  1.0 3.0
   38    43    50    58   0.56750  1.0 1.0
   38    43    50    58  -0.07550 -1.0 2.0
   38    43    50    58   0.20000  1.0 3.0
   43    50    58    59   0.00000  1.0 1.0
   43    50    58    62  -0.43950  1.0 1.0
   43    50    58    62  -0.08100 -1.0 2.0
   43    50    58    62   0.03350  1.0 3.0
   44    43    50    51   0.15000  1.0 3.0
   44    43    50    52   0.15000  1.0 3.0
   44    43    50    58   0.15000  1.0 3.0
   45    43    50    51   0.15000  1.0 3.0
   45    43    50    52   0.15000  1.0 3.0
   45    43    50    58   0.15000  1.0 3.0
   50    58    62    63   3.04450 -1.0 2.0
   50    58    62    70   1.49850  1.0 1.0
   50    58    62    70   1.53950 -1.0 2.0
   51    50    58    59   0.00000  1.0 1.0
   51    50    58    62   0.00000  1.0 1.0
   52    50    58    59   0.00000  1.0 1.0
   52    50    58    62   0.00000  1.0 1.0
   58    62    70    71   0.00000  1.0 1.0
   58    62    70    72   0.00000  1.0 1.0
   58    62    70    73   0.00000  1.0 1.0
   59    58    62    63   2.45000 -1.0 2.0
   59    58    62    70   2.45000 -1.0 2.0
   63    62    70    71   0.00000  1.0 1.0
   63    62    70    72   0.00000  1.0 1.0
   63    62    70    73   0.00000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    39    37    40   1.10000 -1.0 2.0
   48    46    39    37   1.00000 -1.0 2.0
   39    53    46    47  10.50000 -1.0 2.0
   41    42    40    37   1.10000 -1.0 2.0
   59    62    58    50   1.00000 -1.0 2.0
   58    70    62    63  10.50000 -1.0 2.0
END
