* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    142    223     417
    1     0 S   NP   _N1_     1    28.67763    95.02902   -22.72369
    2     1 S   H    _HN1     2     1.02976    83.29358    26.96910
    3     1 S   H    _H1_     3     1.02819    30.00217   169.54492
    4     1 S   H    _H2_     4     1.02776    99.35720   -80.53124
    5     1 S   CT   _CA1     5     1.50173   138.17447   140.05036
    6     5 S   HC   _HA1     6     1.09585   105.18479    74.41109
    7     5 S   CO3  _C1_     7     1.53773   112.47578   -45.53991
    8     7 S   O2Z  _O11     8     1.26345   115.03678   -41.17445
    9     7 S   O2Z  _O12     9     1.26262   114.91588   137.86587
   10     5 S   CT   _CB1    10     1.53062   107.29020  -167.90323
   11    10 S   HC   HB11    11     1.09819   109.03008   -52.26662
   12    10 S   HC   HB12    12     1.09827   110.43764    64.10639
   13    10 S   CT   _CG1    13     1.53012   112.91651  -173.60542
   14    13 S   HC   HG11    14     1.09597   110.22458   -65.78020
   15    13 S   HC   HG12    15     1.09640   110.19842    53.45201
   16    13 S   C    _CD1    16     1.51813   112.19090   173.39523
   17    16 S   O    _OE1    17     1.22718   123.17529   -11.89766
   18    16 S   N    _N2_    18     1.38627   111.83528   169.35571
   19    18 S   H    _HN2    19     1.01566   119.10028     1.61846
   20    18 S   CT1  _CA2    20     1.46083   123.24157  -179.75531
   21    20 S   HC   _HA2    21     1.09602   109.38233    -2.17006
   22    20 S   C    _C2_    22     1.53506   108.83026  -117.54178
   23    22 S   O    _O2_    23     1.23054   122.06837  -146.80450
   24    20 S   CT   _CB2    32     1.53349   111.59772   120.06856
   25    24 S   HC   HB21    33     1.09657   109.66206    61.57696
   26    24 S   HC   HB22    34     1.09575   110.89902   178.91285
   27    22 S   N    _N3_    24     1.38463   113.63750    40.61850
   28    27 S   H    _HN3    25     1.01503   118.97168    -0.58283
   29    24 S   S    _SG2    35     1.82787   114.68517   -58.33841
   30    27 S   CT   _CA3    26     1.45442   123.46285   175.28640
   31    30 S   HC   HA31    27     1.09520   109.34970    23.48772
   32    30 S   HC   HA32    28     1.09502   107.13203   140.46027
   33    29 S   CT   _C18    36     1.82191    99.82294   -66.14226
   34    33 S   HC   _H19    37     1.09382   109.60790   -46.67430
   35    33 S   HC   _H20    38     1.09354   108.45257    70.12509
   36    30 S   CO3  _C3_    29     1.52883   112.87110  -100.05537
   37    36 S   O2Z  _O31    30     1.26413   115.25999   -49.95722
   38    36 S   O2Z  _O32    31     1.26331   115.08896   130.90832
   39    33 S   CM   _C17    39     1.50222   110.19797  -167.97598
   40    39 S   CMA  _C16    40     1.34976   127.37470  -109.06869
   41    40 S   OM   _O36    41     1.26287   128.09680    -0.33977
   42    40 S   OS   _O35    42     1.41802   109.68458  -179.43076
   43    42 S   CT   _C12    43     1.44333   106.72095   -14.25350
   44    43 S   HC   _H4_    44     1.09925   106.64238   -93.69021
   45    43 S   CT   _C13    45     1.52768   107.11342   149.49141
   46    45 S   HC   _H15    46     1.09828   110.40475   -51.27302
   47    45 S   HC   _H16    47     1.10007   105.75784    61.04283
   48    39 S   CT   _C11    55     1.49927   121.12250    72.64417
   49    48 S   HC   _H3_    56     1.09756   110.51909   -52.35343
   50    45 S   CT   _C14    48     1.53247   116.20936  -177.87394
   51    50 S   CM   _C8_    49     1.53121   117.11453    63.35582
   52    50 S   CT   _C15    65     1.53893   109.21050  -168.28092
   53    52 S   HC   _H17    66     1.09470   113.85784   -90.38639
   54    52 S   HC   _H18    67     1.09559   112.34739    33.15358
   55    51 S   CM   _C9_    50     1.34535   127.05912    -5.33733
   56    55 S   HC   _H12    51     1.08947   118.09308   178.96240
   57    51 S   CT   _C7_    57     1.52000   113.84291   177.67889
   58    57 S   HC   _H10    58     1.09638   112.12611   162.57331
   59    57 S   HC   _H11    59     1.09713   108.85931   -79.77887
   60    55 S   CT   _C10    52     1.50020   127.62618    -6.21574
   61    60 S   HC   _H13    53     1.09621   110.49991    78.24033
   62    60 S   HC   _H14    54     1.09727   106.59660  -167.53084
   63    57 S   CT   _C6_    60     1.53767   110.50442    40.70673
   64    63 S   HC   _H8_    61     1.09737   108.91516    79.44631
   65    63 S   HC   _H9_    62     1.09616   108.73137  -162.98102
   66    63 S   CO   _C5_    63     1.53780   110.46394   -41.05674
   67    66 S   OS   _O34    64     1.43468   108.09157   -55.36999
   68    50 S   OS   _O33    68     1.43806   110.26641   -58.73149
   69    66 S   CT   _C4_    69     1.51626   112.57066  -177.42481
   70    69 S   HC   _H5_    70     1.09595   110.31085  -179.63256
   71    69 S   HC   _H6_    71     1.09478   111.32278    61.45665
   72    69 S   HC   _H7_    72     1.09481   111.32817   -60.72004
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  14   7  15   6   5   8
   4  15  17   9   4   3   9   4  10   5   4   2   1   1   9   5
   4   6   5   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    60    48    49  
   35    39    40    48  
   39    40    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    55    60    61    62    48    49  
   41    42    43    44    45    60    48    49  
   42    43    48  
   43    44    45    46    47    50    60    48    49  
   44    45    46    47    50    51    55    60    61    62    48    49    52    68  
   45    46    47    50    60    48    49  
   46    47    50    51    55    60    48    49    57    66    67    52    53    54    68  
   47    50    51    48    52    68  
   50    51    48    52    68  
   49    50    51    55    56    60    61    62  
   55    60    61    62  
   51    55    56    60    57    58    59    63    66    67    52    53    54    68    69  
   55    56    60    61    62    57    58    59    63    64    65    66    67    52    53    54    68  
   53    54    68    69    55    57    63    66    67  
   54    68    66    67  
   68    66    67  
   56    60    61    62    57    58    59    63    68  
   60    61    62    57  
   58    59    63    64    65    66    67    68    69    60  
   59    63    64    65    66  
   63    64    65    66  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70    71    72  
   65    66    67    68    69  
   66    67    68    69  
   67    68    69    70    71    72  
   68    69    70    71    72  
   69    70    71    72  
   70    71    72  
   71    72  
   72  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.269000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.400000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    48   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    48   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    50   268.000  1.529
   50    51   317.000  1.510
   50    52   268.000  1.529
   50    68   320.000  1.410
   51    55   549.000  1.340
   51    57   317.000  1.510
   55    56   340.000  1.080
   55    60   317.000  1.510
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    48   268.000  1.529
   48    49   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   250.000  1.527
   66    67   320.000  1.380
   66    68   320.000  1.380
   66    69   250.000  1.527
   67    52   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    48    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    48    43    70.00000  112.02700
   39    48    60    70.00000  112.02700
   39    48    49    35.00000  109.50000
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    48    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    50    58.35000  112.70000
   43    48    60    58.35000  112.70000
   43    48    49    37.50000  110.70000
   45    43    44    37.50000  110.70000
   45    50    51    70.00000  112.02700
   45    50    52    58.35000  112.70000
   45    50    68    50.00000  109.50000
   47    45    46    33.00000  107.80000
   50    45    46    37.50000  110.70000
   50    45    47    37.50000  110.70000
   50    51    55    70.00000  124.00000
   50    51    57    65.00000  117.92700
   50    52    67    50.00000  109.50000
   50    52    53    37.50000  110.70000
   50    52    54    37.50000  110.70000
   50    68    66    60.00000  109.50000
   51    55    56    35.00000  120.00000
   51    55    60    70.00000  124.00000
   51    57    58    35.00000  109.50000
   51    57    59    35.00000  109.50000
   51    57    63    70.00000  112.02700
   55    60    61    35.00000  109.50000
   55    60    62    35.00000  109.50000
   55    60    48    70.00000  112.02700
   60    55    56    35.00000  117.00000
   60    48    49    37.50000  110.70000
   62    60    61    33.00000  107.80000
   48    39    40    70.00000  124.00000
   48    43    44    37.50000  110.70000
   48    43    45    58.35000  112.70000
   48    60    61    37.50000  110.70000
   48    60    62    37.50000  110.70000
   57    51    55    70.00000  124.00000
   57    63    64    37.50000  110.70000
   57    63    65    37.50000  110.70000
   57    63    66    75.00000  109.43000
   59    57    58    33.00000  107.80000
   63    57    58    37.50000  110.70000
   63    57    59    37.50000  110.70000
   63    66    67    90.00000  108.56700
   63    66    68    90.00000  108.56700
   63    66    69    65.00000  112.71400
   65    63    64    33.00000  107.80000
   66    63    64    45.00000  108.72000
   66    63    65    45.00000  108.72000
   66    67    52    60.00000  109.50000
   66    69    70    45.00000  108.72000
   66    69    71    45.00000  108.72000
   66    69    72    45.00000  108.72000
   67    52    53    35.00000  109.50000
   67    52    54    35.00000  109.50000
   52    50    51    70.00000  112.02700
   54    52    53    33.00000  107.80000
   68    50    51    85.00000  110.90400
   68    50    52    50.00000  109.50000
   68    66    67    92.60000  111.55000
   69    66    67    90.00000  108.56700
   69    66    68    90.00000  108.56700
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    48   0.30250  1.0 1.0
   29    33    39    48  -0.14950 -1.0 2.0
   29    33    39    48   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    48    43   0.46850  1.0 1.0
   33    39    48    43   0.08550 -1.0 2.0
   33    39    48    43   0.09800  1.0 3.0
   33    39    48    60   0.46850  1.0 1.0
   33    39    48    60   0.08550 -1.0 2.0
   33    39    48    60   0.09800  1.0 3.0
   33    39    48    49   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    48   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    48   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   40    39   -48    43   0.09850  1.0 1.0
   40    39   -48    43   0.15250 -1.0 2.0
   40    39   -48    43  -0.50650  1.0 3.0
   40    39    48    60   0.09850  1.0 1.0
   40    39    48    60   0.15250 -1.0 2.0
   40    39    48    60  -0.50650  1.0 3.0
   40    39    48    49   0.00000  1.0 1.0
   40    42    43    44   0.08050  1.0 3.0
   40    42    43    45  -0.46850  1.0 1.0
   40    42    43    45   0.09300 -1.0 2.0
   40    42    43    45  -0.12850  1.0 3.0
   40    42   -43    48  -0.46850  1.0 1.0
   40    42   -43    48   0.09300 -1.0 2.0
   40    42   -43    48  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    47   0.23400  1.0 3.0
   42    43    45    50   0.62750  1.0 1.0
   42    43    45    50  -0.30950 -1.0 2.0
   42    43    45    50   0.27300  1.0 3.0
   42    43   -48    39   0.61850  1.0 1.0
   42    43   -48    39  -0.22750 -1.0 2.0
   42    43   -48    39   0.15300  1.0 3.0
   42    43    48    60   0.62750  1.0 1.0
   42    43    48    60  -0.30950 -1.0 2.0
   42    43    48    60   0.27300  1.0 3.0
   42    43    48    49   0.23400  1.0 3.0
   43    45    50    51   0.34400  1.0 1.0
   43    45    50    51   0.09450 -1.0 2.0
   43    45    50    51   0.11100  1.0 3.0
   43    45    50    52   0.56750  1.0 1.0
   43    45    50    52  -0.07550 -1.0 2.0
   43    45    50    52   0.20000  1.0 3.0
   43    45    50    68   0.62750  1.0 1.0
   43    45    50    68  -0.30950 -1.0 2.0
   43    45    50    68   0.27300  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    50   0.15000  1.0 3.0
   44    43    48    39   0.15000  1.0 3.0
   44    43    48    60   0.15000  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   45    43    48    39   0.34400  1.0 1.0
   45    43    48    39   0.09450 -1.0 2.0
   45    43    48    39   0.11100  1.0 3.0
   45    43    48    60   0.56750  1.0 1.0
   45    43    48    60  -0.07550 -1.0 2.0
   45    43    48    60   0.20000  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    50    51    55   0.09850  1.0 1.0
   45    50    51    55   0.15250 -1.0 2.0
   45    50    51    55  -0.50650  1.0 3.0
   45    50    51    57   0.46850  1.0 1.0
   45    50    51    57   0.08550 -1.0 2.0
   45    50    51    57   0.09800  1.0 3.0
   45    50    52    67   0.62750  1.0 1.0
   45    50    52    67  -0.30950 -1.0 2.0
   45    50    52    67   0.27300  1.0 3.0
   45    50    52    53   0.15000  1.0 3.0
   45    50    52    54   0.15000  1.0 3.0
   45    50    68    66   0.06250  1.0 1.0
   45    50    68    66  -0.01100 -1.0 2.0
   45    50    68    66   0.28050  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    68   0.23400  1.0 3.0
   47    45    50    51   0.15000  1.0 3.0
   47    45    50    52   0.15000  1.0 3.0
   47    45    50    68   0.23400  1.0 3.0
   50    51    55    56   7.00000 -1.0 2.0
   50    51    55    60   7.00000 -1.0 2.0
   50    51    57    58   0.34800  1.0 3.0
   50    51    57    59   0.34800  1.0 3.0
   50    51    57    63   0.46850  1.0 1.0
   50    51    57    63   0.08550 -1.0 2.0
   50    51    57    63   0.09800  1.0 3.0
   51    50    52    67   0.61850  1.0 1.0
   51    50    52    67  -0.22750 -1.0 2.0
   51    50    52    67   0.15300  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    68    66  -0.77900  1.0 1.0
   51    50    68    66  -0.36900 -1.0 2.0
   51    50    68    66   0.40400  1.0 3.0
   51    55    60    61   0.00000  1.0 1.0
   51    55    60    62   0.00000  1.0 1.0
   51    55    60    48   0.09850  1.0 1.0
   51    55    60    48   0.15250 -1.0 2.0
   51    55    60    48  -0.50650  1.0 3.0
   51    57    63    64   0.15000  1.0 3.0
   51    57    63    65   0.15000  1.0 3.0
   51    57   -63    66   0.34400  1.0 1.0
   51    57   -63    66   0.09450 -1.0 2.0
   51    57   -63    66   0.11100  1.0 3.0
   55    51    57    58   0.00000  1.0 1.0
   55    51    57    59   0.00000  1.0 1.0
   55    51    57    63   0.09850  1.0 1.0
   55    51    57    63   0.15250 -1.0 2.0
   55    51    57    63  -0.50650  1.0 3.0
   55    60    48    39   0.31000  1.0 1.0
   55    60    48    39   0.14700 -1.0 2.0
   55    60    48    39   0.07550  1.0 3.0
   55    60    48    43   0.34400  1.0 1.0
   55    60    48    43   0.09450 -1.0 2.0
   55    60    48    43   0.11100  1.0 3.0
   55    60    48    49   0.15000  1.0 3.0
   56    55    60    61   0.33100  1.0 3.0
   56    55    60    62   0.33100  1.0 3.0
   56    55    60    48   0.00000  1.0 1.0
   61    60    48    39   0.15000  1.0 3.0
   61    60    48    43   0.15000  1.0 3.0
   61    60    48    49   0.15000  1.0 3.0
   62    60    48    39   0.15000  1.0 3.0
   62    60    48    43   0.15000  1.0 3.0
   62    60    48    49   0.15000  1.0 3.0
   48    39    40    41   7.00000 -1.0 2.0
   48    39   -40    42   7.00000 -1.0 2.0
   48    43    45    46   0.15000  1.0 3.0
   48    43    45    47   0.15000  1.0 3.0
   48    43    45    50   0.56750  1.0 1.0
   48    43    45    50  -0.07550 -1.0 2.0
   48    43    45    50   0.20000  1.0 3.0
   57    51    55    56   7.00000 -1.0 2.0
   57    51    55    60   7.00000 -1.0 2.0
   57    63    66    67   0.62750  1.0 1.0
   57    63    66    67  -0.30950 -1.0 2.0
   57    63    66    67   0.27300  1.0 3.0
   57    63    66    68   0.62750  1.0 1.0
   57    63    66    68  -0.30950 -1.0 2.0
   57    63    66    68   0.27300  1.0 3.0
   57    63    66    69   0.56750  1.0 1.0
   57    63    66    69  -0.07550 -1.0 2.0
   57    63    66    69   0.20000  1.0 3.0
   58    57    63    64   0.15000  1.0 3.0
   58    57    63    65   0.15000  1.0 3.0
   58    57    63    66   0.15000  1.0 3.0
   59    57    63    64   0.15000  1.0 3.0
   59    57    63    65   0.15000  1.0 3.0
   59    57    63    66   0.15000  1.0 3.0
   63    66    67    52   0.06250  1.0 1.0
   63    66    67    52  -0.01100 -1.0 2.0
   63    66    67    52   0.28050  1.0 3.0
   63    66   -68    50   0.06250  1.0 1.0
   63    66   -68    50  -0.01100 -1.0 2.0
   63    66   -68    50   0.28050  1.0 3.0
   63    66    69    70   0.15000  1.0 3.0
   63    66    69    71   0.15000  1.0 3.0
   63    66    69    72   0.15000  1.0 3.0
   64    63    66    67   0.23400  1.0 3.0
   64    63    66    68   0.23400  1.0 3.0
   64    63    66    69   0.15000  1.0 3.0
   65    63    66    67   0.23400  1.0 3.0
   65    63    66    68   0.23400  1.0 3.0
   65    63    66    69   0.15000  1.0 3.0
   66    67   -52    50   0.06250  1.0 1.0
   66    67   -52    50  -0.01100 -1.0 2.0
   66    67   -52    50   0.28050  1.0 3.0
   66    67    52    53   0.37050  1.0 3.0
   66    67    52    54   0.37050  1.0 3.0
   67    66   -68    50  -0.53350  1.0 1.0
   67    66   -68    50  -0.78350 -1.0 2.0
   67    66   -68    50   0.33750  1.0 3.0
   67    66    69    70   0.23400  1.0 3.0
   67    66    69    71   0.23400  1.0 3.0
   67    66    69    72   0.23400  1.0 3.0
   52    50    51    55   0.09850  1.0 1.0
   52    50    51    55   0.15250 -1.0 2.0
   52    50    51    55  -0.50650  1.0 3.0
   52    50    51    57   0.46850  1.0 1.0
   52    50    51    57   0.08550 -1.0 2.0
   52    50    51    57   0.09800  1.0 3.0
   52    50   -68    66   0.06250  1.0 1.0
   52    50   -68    66  -0.01100 -1.0 2.0
   52    50   -68    66   0.28050  1.0 3.0
   68    50    51    55   0.39000  1.0 1.0
   68    50    51    55  -0.05800 -1.0 2.0
   68    50    51    55  -0.55150  1.0 3.0
   68    50   -51    57   0.09700  1.0 1.0
   68    50   -51    57   0.15600 -1.0 2.0
   68    50   -51    57  -0.50800  1.0 3.0
   68    50   -52    67   1.11900  1.0 1.0
   68    50   -52    67  -1.16350 -1.0 2.0
   68    50   -52    67  -0.34150  1.0 3.0
   68    50    52    53   0.23400  1.0 3.0
   68    50    52    54   0.23400  1.0 3.0
   68    66   -67    52  -0.53350  1.0 1.0
   68    66   -67    52  -0.78350 -1.0 2.0
   68    66   -67    52   0.33750  1.0 3.0
   68    66    69    70   0.23400  1.0 3.0
   68    66    69    71   0.23400  1.0 3.0
   68    66    69    72   0.23400  1.0 3.0
   69    66    67    52   0.06250  1.0 1.0
   69    66    67    52  -0.01100 -1.0 2.0
   69    66    67    52   0.28050  1.0 3.0
   69    66    68    50   0.06250  1.0 1.0
   69    66    68    50  -0.01100 -1.0 2.0
   69    66    68    50   0.28050  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   33    48    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   50    57    51    55   1.10000 -1.0 2.0
   60    56    55    51   1.10000 -1.0 2.0
END
