* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    137    217     403
    1     0 S   NP   _N1_     1    29.93814    90.86806   -24.74880
    2     1 S   H    _HN1     2     1.02958    80.96535    43.46204
    3     1 S   H    _H1_     3     1.02838    26.63348  -124.60380
    4     1 S   H    _H2_     4     1.02774   122.76403   -62.60529
    5     1 S   CT   _CA1     5     1.50110   116.49888   151.83612
    6     5 S   HC   _HA1     6     1.09575   105.22501    87.63474
    7     5 S   CO3  _C1_     7     1.53788   112.38698   -32.56215
    8     7 S   O2Z  _O11     8     1.26359   114.99823   -43.72622
    9     7 S   O2Z  _O12     9     1.26238   114.91890   135.46455
   10     5 S   CT   _CB1    10     1.53116   107.45562  -154.45058
   11    10 S   HC   HB11    11     1.09825   109.33997   -50.74384
   12    10 S   HC   HB12    12     1.09816   110.42426    65.81731
   13    10 S   CT   _CG1    13     1.53013   112.65544  -171.83206
   14    13 S   HC   HG11    14     1.09592   110.47159   -64.06908
   15    13 S   HC   HG12    15     1.09656   109.94730    55.14386
   16    13 S   C    _CD1    16     1.51804   112.35751   175.50364
   17    16 S   O    _OE1    17     1.22755   123.37626    -1.00483
   18    16 S   N    _N2_    18     1.38767   111.67006   179.32681
   19    18 S   H    _HN2    19     1.01608   119.07332     2.38491
   20    18 S   CT1  _CA2    20     1.45977   123.06239   179.45643
   21    20 S   HC   _HA2    21     1.09665   108.40531     4.43478
   22    20 S   C    _C2_    22     1.53524   111.06335  -109.99129
   23    22 S   O    _O2_    23     1.23137   121.46353  -160.35378
   24    20 S   CT   _CB2    32     1.53549   111.34674   125.53383
   25    24 S   HC   HB21    33     1.09602   110.64225    47.36469
   26    24 S   HC   HB22    34     1.09354   111.31804   165.66506
   27    22 S   N    _N3_    24     1.38278   114.29944    27.74109
   28    27 S   H    _HN3    25     1.01473   119.11390    -3.03209
   29    24 S   S    _SG2    35     1.83232   110.56813   -72.04147
   30    27 S   CT   _CA3    26     1.45456   123.35945   173.52098
   31    30 S   HC   HA31    27     1.09524   109.41207    27.60216
   32    30 S   HC   HA32    28     1.09499   107.32036   144.62918
   33    29 S   CA   _C18    36     1.80855   100.37897  -132.25130
   34    30 S   CO3  _C3_    29     1.52728   112.04091   -95.44366
   35    34 S   O2Z  _O31    30     1.26439   115.12566   -66.95210
   36    34 S   O2Z  _O32    31     1.26299   115.41753   112.29569
   37    33 S   CA   _C13    37     1.42268   120.88326    75.31123
   38    37 S   CA   _C14    38     1.40879   118.92115   178.50918
   39    38 S   HA   _H19    39     1.08935   119.72986   179.96044
   40    37 S   CA   _C11    46     1.47438   123.09846    -2.48475
   41    38 S   CA   _C15    40     1.39309   120.88536    -0.27411
   42    41 S   Cl   Cl2_    41     1.72189   119.73369  -179.97202
   43    40 S   CA   _C10    47     1.39203   119.56857  -101.67809
   44    43 S   HA   _H16    48     1.08336   123.90046    -1.68051
   45    41 S   CA   _C16    42     1.38972   120.46571     0.03956
   46    45 S   HA   _H20    43     1.08791   119.95976  -179.94405
   47    43 S   NAP  _N6_    49     1.33577   120.87788   176.35675
   48    47 S   H    _H15    50     1.01619   118.32402  -179.84549
   49    33 S   CA   _C17    44     1.41175   119.98789  -106.70905
   50    49 S   Cl   Cl1_    45     1.73418   122.59920     1.76092
   51    47 S   CQ   _C9_    51     1.34684   121.49142     0.71737
   52    51 S   NB   _N7_    52     1.36938   120.25059     3.14411
   53    51 S   NE   _N5_    57     1.40218   119.03821  -177.02507
   54    40 S   CA   _C12    53     1.39866   123.95056    77.60815
   55    53 S   CT   _C6_    58     1.46922   115.67028  -177.62529
   56    55 S   HC   _H9_    59     1.09717   110.84295    46.82697
   57    55 S   HC   _H10    60     1.09785   109.58692   -72.04705
   58    54 S   NE   _N8_    54     1.39153   120.91326     5.33120
   59    58 S   H    _H17    55     1.01189   119.26821   -31.91879
   60    58 S   H    _H18    56     1.01269   116.53791   178.55979
   61    55 S   CT   _C5_    61     1.52566   111.42854   166.32893
   62    61 S   HC   _H7_    62     1.09491   110.65881   171.84671
   63    61 S   HC   _H8_    63     1.09605   111.72224   -65.77512
   64    61 S   NP   _N4_    64     1.50850   109.56829    53.25574
   65    64 S   H    _H6_    65     1.02975   107.97022    57.26505
   66    64 S   CT   _C8_    66     1.50825   110.56914   -60.02881
   67    66 S   HC   _H13    67     1.09609   107.48340   -61.69988
   68    66 S   HC   _H14    68     1.09449   107.66625  -179.55987
   69    64 S   CT   _C4_    72     1.50209   112.09169   174.36396
   70    69 S   HC   _H3_    73     1.09326   108.69795    62.36611
   71    69 S   HC   _H4_    74     1.09312   108.04832  -177.03852
   72    69 S   HC   _H5_    75     1.09309   108.01997   -58.19255
   73    53 S   CT   _C7_    69     1.46868   117.40512    38.50487
   74    73 S   HC   _H11    70     1.09672   108.70793    71.38223
   75    73 S   HC   _H12    71     1.09307   112.05782   -47.46665
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  11   2   1   1  14   9   4  12   5   3   8   4   3   2   7   3
   1   1  12   7  14   3  12   6   5   2   1   1  12   5   4  11
   8   9   5   4   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    49    50    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    45    46    49    50    40    43    54  
   35    36  
   36  
    0  
   38    39    41    42    45    49    50    40    43    44    47    52    54    58  
   39    41    42    45    46    49    40    43    54  
   41    42    45    40  
   43    44    47    48    51    52    54    58    59    60    41    49  
   42    45    46    49    50  
   45    46    49  
   44    47    48    51    52    54    58    53  
   47    48    51    54  
   46    49    50  
   49    50  
   48    51    52    54    53    55    73  
   51    52    53  
   50  
    0  
   52    54    58    53    55    56    57    61    66    73    74    75  
   54    58    59    60    53    55    73  
   55    56    57    61    62    63    64    66    67    68    73    74    75    54  
   58    59    60  
   56    57    61    62    63    64    65    66    73    74    75    69  
   57    61    62    63    64    73  
   61    62    63    64    73  
   59    60  
   60  
    0  
   62    63    64    65    66    67    68    73    69    70    71    72  
   63    64    65    66    69  
   64    65    66    69  
   65    66    67    68    73    74    75    69    70    71    72  
   66    67    68    73    69    70    71    72  
   67    68    73    74    75    69    70    71    72  
   68    73    74    75    69  
   73    74    75    69  
   70    71    72    73  
   71    72  
   72  
    0  
   74    75  
   75  
    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  -0.320000   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   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   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   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   39   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   40   3.5500   0.0700  -0.378800   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5500   0.0700   0.505300   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.141700   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.2500   0.1700  -1.134900   1.9750   1.7500   0.001000000  -0.511443539
   48   0.0000   0.0000   0.431900   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5500   0.0700   1.021200   2.0020   1.7750   0.001000000  -0.843144165
   52   3.2800   0.1700  -0.709200   1.8650   1.6500   0.001000000  -0.511443539
   53   3.3000   0.1700  -0.120000   1.9050   1.6860   0.051222218  -2.220205820
   54   3.5500   0.0700   1.022800   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   57   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.3000   0.1700  -0.920000   1.8650   1.6500   0.051222218  -2.220205820
   59   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   60   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   65   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   75   2.5000   0.0150   0.060000   1.6450   1.4500   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   250.000  1.760
   33    37   469.000  1.400
   33    49   469.000  1.400
   37    38   469.000  1.400
   37    40   375.000  1.464
   38    39   367.000  1.080
   38    41   469.000  1.400
   41    42   300.000  1.725
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   300.000  1.725
   40    43   469.000  1.400
   40    54   469.000  1.400
   43    44   367.000  1.080
   43    47   485.000  1.342
   47    48   475.000  1.020
   47    51   535.000  1.326
   51    52   502.000  1.324
   51    53   410.000  1.375
   52    54   483.000  1.339
   54    58   481.000  1.340
   58    59   434.000  1.010
   58    60   434.000  1.010
   53    55   382.000  1.448
   53    73   382.000  1.448
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   367.000  1.471
   64    65   434.000  1.010
   64    66   367.000  1.471
   64    69   367.000  1.471
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   268.000  1.529
   73    74   340.000  1.090
   73    75   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    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  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    49    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    40    60.00000  122.76000
   33    49    45    63.00000  120.00000
   33    49    50    75.00000  120.00000
   37    38    39    35.00000  120.00000
   37    38    41    63.00000  120.00000
   37    40    43    60.00000  122.76000
   37    40    54    60.00000  122.76000
   38    41    42    75.00000  120.00000
   38    41    45    63.00000  120.00000
   41    38    39    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    49    63.00000  120.00000
   45    41    42    75.00000  120.00000
   45    49    50    75.00000  120.00000
   49    33    37    63.00000  120.00000
   49    45    46    35.00000  120.00000
   40    37    38    60.00000  122.76000
   40    43    44    35.00000  120.00000
   40    43    47    70.00000  119.29800
   40    54    52    70.00000  124.00000
   40    54    58    70.00000  120.10000
   43    47    48    45.00000  117.56800
   43    47    51    80.00000  116.44700
   47    43    44    45.00000  112.84900
   47    51    52    80.00000  118.80000
   47    51    53    85.00000  116.09700
   51    47    48    45.00000  118.71300
   51    52    54    70.00000  118.60000
   51    53    55    50.00000  123.00000
   51    53    73    50.00000  123.00000
   52    54    58    80.00000  117.25000
   54    40    43    63.00000  120.00000
   54    58    59    35.00000  113.50000
   54    58    60    35.00000  113.50000
   60    58    59    35.00000  109.00000
   53    51    52    85.00000  116.09700
   53    55    56    35.00000  109.50000
   53    55    57    35.00000  109.50000
   53    55    61    80.00000  111.61500
   53    73    66    80.00000  111.61500
   53    73    74    35.00000  109.50000
   53    73    75    35.00000  109.50000
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    64    80.00000  111.20000
   57    55    56    33.00000  107.80000
   61    55    56    37.50000  110.70000
   61    55    57    37.50000  110.70000
   61    64    65    35.00000  109.50000
   61    64    66    75.00000  113.01200
   61    64    69    75.00000  113.01200
   63    61    62    33.00000  107.80000
   64    61    62    35.00000  109.50000
   64    61    63    35.00000  109.50000
   64    66    67    35.00000  109.50000
   64    66    68    35.00000  109.50000
   64    66    73    80.00000  111.20000
   64    69    70    35.00000  109.50000
   64    69    71    35.00000  109.50000
   64    69    72    35.00000  109.50000
   66    64    65    35.00000  109.50000
   66    73    74    37.50000  110.70000
   66    73    75    37.50000  110.70000
   68    66    67    33.00000  107.80000
   73    53    55    50.00000  115.00000
   73    66    67    37.50000  110.70000
   73    66    68    37.50000  110.70000
   75    73    74    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    66    75.00000  113.01200
   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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    49   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    40   3.62500 -1.0 2.0
   29    33    49    45   3.62500 -1.0 2.0
   29    33    49    50   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    41   3.62500 -1.0 2.0
   33    37    40    43  -0.19450  1.0 1.0
   33    37    40    43   0.63300 -1.0 2.0
   33    37    40    43   0.07450  1.0 3.0
   33    37    40    54  -0.19450  1.0 1.0
   33    37    40    54   0.63300 -1.0 2.0
   33    37    40    54   0.07450  1.0 3.0
   37    33    49    45   3.62500 -1.0 2.0
   37    33    49    50   3.62500 -1.0 2.0
   37    38    41    42   3.62500 -1.0 2.0
   37    38   -41    45   3.62500 -1.0 2.0
   37    40    43    44   3.62500 -1.0 2.0
   37    40    43    47   3.62500 -1.0 2.0
   37    40    54    52   3.62500 -1.0 2.0
   37    40    54    58   3.62500 -1.0 2.0
   38    37    40    43  -0.19450  1.0 1.0
   38    37    40    43   0.63300 -1.0 2.0
   38    37    40    43   0.07450  1.0 3.0
   38    37    40    54  -0.19450  1.0 1.0
   38    37    40    54   0.63300 -1.0 2.0
   38    37    40    54   0.07450  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    49   3.62500 -1.0 2.0
   39    38    41    42   3.62500 -1.0 2.0
   39    38    41    45   3.62500 -1.0 2.0
   41    45   -49    33   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   46    45    49    33   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   49    33   -37    38   3.62500 -1.0 2.0
   49    33    37    40   3.62500 -1.0 2.0
   40    37    38    39   3.62500 -1.0 2.0
   40    37    38    41   3.62500 -1.0 2.0
   40    43    47    48   3.62500 -1.0 2.0
   40    43    47    51   3.62500 -1.0 2.0
   40    54    58    59   1.00000 -1.0 2.0
   40    54    58    60   1.00000 -1.0 2.0
   43    40    54    52   3.62500 -1.0 2.0
   43    40    54    58   3.62500 -1.0 2.0
   43    47   -51    52   3.62500 -1.0 2.0
   43    47    51    53   3.62500 -1.0 2.0
   44    43    47    48   3.62500 -1.0 2.0
   44    43    47    51   3.62500 -1.0 2.0
   47    51    52    54   3.62500 -1.0 2.0
   47    51    53    55  -1.10000  1.0 1.0
   47    51    53    55   1.25000 -1.0 2.0
   47    51    53    73  -1.10000  1.0 1.0
   47    51    53    73   1.25000 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    53   3.62500 -1.0 2.0
   51    52   -54    40   3.62500 -1.0 2.0
   51    52    54    58   3.62500 -1.0 2.0
   51    53    55    56   0.00000  1.0 1.0
   51    53    55    57   0.00000  1.0 1.0
   51    53    55    61   0.92500  1.0 1.0
   51    53    55    61   0.12150 -1.0 2.0
   51    53    55    61  -0.25000  1.0 3.0
   51    53    73    66   0.92500  1.0 1.0
   51    53    73    66   0.12150 -1.0 2.0
   51    53    73    66  -0.25000  1.0 3.0
   51    53    73    74   0.00000  1.0 1.0
   51    53    73    75   0.00000  1.0 1.0
   52    51    53    55  -1.10000  1.0 1.0
   52    51    53    55   1.25000 -1.0 2.0
   52    51    53    73  -1.10000  1.0 1.0
   52    51    53    73   1.25000 -1.0 2.0
   52    54    58    59   1.75000 -1.0 2.0
   52    54    58    60   1.75000 -1.0 2.0
   54    40    43    44   3.62500 -1.0 2.0
   54    40   -43    47   3.62500 -1.0 2.0
   53    51    52    54   3.62500 -1.0 2.0
   53    55    61    62   0.22950  1.0 3.0
   53    55    61    63   0.22950  1.0 3.0
   53    55    61    64   2.45700  1.0 1.0
   53    55    61    64   1.17300 -1.0 2.0
   55    53    73    66   0.00000  1.0 1.0
   55    53    73    74   0.00000  1.0 1.0
   55    53    73    75   0.00000  1.0 1.0
   55    61    64    65   0.17350  1.0 3.0
   55    61   -64    66   0.47100  1.0 1.0
   55    61    64    69   0.47100  1.0 1.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    63   0.15000  1.0 3.0
   56    55    61    64   0.19200  1.0 3.0
   57    55    61    62   0.15000  1.0 3.0
   57    55    61    63   0.15000  1.0 3.0
   57    55    61    64   0.19200  1.0 3.0
   61    64    66    67   0.15000  1.0 3.0
   61    64    66    68   0.15000  1.0 3.0
   61    64    66    73   0.47100  1.0 1.0
   61    64    69    70   0.15000  1.0 3.0
   61    64    69    71   0.15000  1.0 3.0
   61    64    69    72   0.15000  1.0 3.0
   62    61    64    65   0.13050  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    69   0.15000  1.0 3.0
   63    61    64    65   0.13050  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   63    61    64    69   0.15000  1.0 3.0
   64    66   -73    53   2.45700  1.0 1.0
   64    66   -73    53   1.17300 -1.0 2.0
   64    66    73    74   0.19200  1.0 3.0
   64    66    73    75   0.19200  1.0 3.0
   65    64    66    67   0.13050  1.0 3.0
   65    64    66    68   0.13050  1.0 3.0
   65    64    66    73   0.17350  1.0 3.0
   65    64    69    70   0.13050  1.0 3.0
   65    64    69    71   0.13050  1.0 3.0
   65    64    69    72   0.13050  1.0 3.0
   66    64    69    70   0.15000  1.0 3.0
   66    64    69    71   0.15000  1.0 3.0
   66    64    69    72   0.15000  1.0 3.0
   67    66    73    53   0.22950  1.0 3.0
   67    66    73    74   0.15000  1.0 3.0
   67    66    73    75   0.15000  1.0 3.0
   68    66    73    53   0.22950  1.0 3.0
   68    66    73    74   0.15000  1.0 3.0
   68    66    73    75   0.15000  1.0 3.0
   73    53    55    56   0.00000  1.0 1.0
   73    53    55    57   0.00000  1.0 1.0
   73    53   -55    61   0.00000  1.0 1.0
   69    64    66    67   0.15000  1.0 3.0
   69    64    66    68   0.15000  1.0 3.0
   69    64    66    73   0.47100  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
   37    49    33    29   4.00000 -1.0 2.0
   38    40    37    33   4.00000 -1.0 2.0
   41    39    38    37   1.10000 -1.0 2.0
   45    42    41    38   4.00000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   45    50    49    33   4.00000 -1.0 2.0
   43    54    40    37   4.00000 -1.0 2.0
   47    44    43    40   1.10000 -1.0 2.0
   48    43    47    51   1.00000 -1.0 2.0
   52    53    51    47   4.00000 -1.0 2.0
   52    58    54    40   4.00000 -1.0 2.0
   60    54    58    59   1.00000 -1.0 2.0
   73    51    53    55   1.00000 -1.0 2.0
END
