* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    131    207     381
    1     0 S   NP   _N1_     1    29.01130    99.12487   -24.80275
    2     1 S   H    _HN1     2     1.02947    70.48963   -36.17114
    3     1 S   H    _H1_     3     1.02830    36.84520   149.19771
    4     1 S   H    _H2_     4     1.02773   123.10312  -135.80027
    5     1 S   CT   _CA1     5     1.50183   121.44798    66.37108
    6     5 S   HC   _HA1     6     1.09576   105.17577    99.06754
    7     5 S   CO3  _C1_     7     1.53820   111.92884   -21.02891
    8     7 S   O2Z  _O11     8     1.26388   115.00754   -50.90109
    9     7 S   O2Z  _O12     9     1.26201   114.94050   127.54341
   10     5 S   CT   _CB1    10     1.53064   107.32272  -143.13178
   11    10 S   HC   HB11    11     1.09840   109.50552   -48.86361
   12    10 S   HC   HB12    12     1.09803   110.46798    67.73712
   13    10 S   CT   _CG1    13     1.53010   112.56348  -169.71212
   14    13 S   HC   HG11    14     1.09573   110.64348   -64.22467
   15    13 S   HC   HG12    15     1.09664   109.78860    54.98544
   16    13 S   C    _CD1    16     1.51861   111.90026   175.66027
   17    16 S   O    _OE1    17     1.22809   123.22910    12.18573
   18    16 S   N    _N2_    18     1.38442   112.02481  -168.25313
   19    18 S   H    _HN2    19     1.01844   119.10551    -1.93603
   20    18 S   CT1  _CA2    20     1.45803   122.76786  -179.23664
   21    20 S   HC   _HA2    21     1.09719   108.38817    37.59786
   22    20 S   C    _C2_    22     1.53026   107.55016   -80.09745
   23    22 S   O    _O2_    23     1.22975   123.17356   -27.52811
   24    20 S   CT   _CB2    32     1.53206   112.26979   160.77173
   25    24 S   HC   HB21    33     1.09547   109.35815    61.24320
   26    24 S   HC   HB22    34     1.09576   110.61109   178.44606
   27    22 S   N    _N3_    24     1.38517   112.45075   155.44098
   28    27 S   H    _HN3    25     1.01642   120.34902    -2.66829
   29    24 S   S    _SG2    35     1.82585   111.59482   -61.63959
   30    27 S   CT   _CA3    26     1.45336   122.48700   178.40161
   31    30 S   HC   HA31    27     1.09568   107.87467   -54.30396
   32    30 S   HC   HA32    28     1.09560   107.56518    62.04822
   33    29 S   CM   _C22    36     1.75759   100.12489   150.75244
   34    30 S   CO3  _C3_    29     1.52884   114.29120  -176.26241
   35    34 S   O2Z  _O31    30     1.26340   116.06257    -0.49377
   36    34 S   O2Z  _O32    31     1.26433   114.40815   179.46186
   37    33 S   CM   _C17    37     1.49405   119.96593   -62.80743
   38    37 S   CM   _C18    38     1.46819   115.46434   145.70191
   39    38 S   HC   _H16    39     1.08535   119.03374  -152.47726
   40    37 S   CMA  _C16    46     1.37242   124.18520   -34.40869
   41    40 S   OM   _O34    47     1.26539   131.83769    -3.42045
   42    38 S   CM   _C19    40     1.33945   120.75721    29.99053
   43    42 S   I    I2__    41     2.04528   122.32129   176.43273
   44    40 S   C5B  _C9_    48     1.44759   120.86964   177.46395
   45    42 S   CO4  _C20    42     1.49382   118.39006    -2.82196
   46    45 S   O    _O35    43     1.22735   121.48421   159.03196
   47    44 S   C56B _C10    49     1.42990   127.13857   -91.38493
   48    44 S   C5A  _C8_    60     1.38613   126.36443    87.85422
   49    33 S   CM   _C21    44     1.35448   121.44117   113.29836
   50    49 S   I    I1__    45     2.08549   126.17621     5.51463
   51    47 S   CA   _C11    50     1.40808   135.94108    -0.40734
   52    51 S   HA   _H12    51     1.08589   121.03174    -0.17246
   53    48 S   CT   _C7_    61     1.48631   134.16169     0.81469
   54    53 S   HC   _H10    62     1.09622   109.89006    19.69760
   55    53 S   HC   _H11    63     1.09686   109.14527   136.25730
   56    51 S   CA   _C12    52     1.40105   118.78926   179.92087
   57    56 S   HA   _H13    53     1.08719   119.36238   179.92598
   58    53 S   CT   _C6_    64     1.52905   111.51519  -102.22884
   59    58 S   HC   _H8_    65     1.09574   109.88256    57.87755
   60    58 S   HC   _H9_    66     1.09750   109.88586   -59.15211
   61    56 S   CA   _C13    54     1.39683   120.98209    -0.04423
   62    61 S   HA   _H14    55     1.08731   119.43874   179.98022
   63    58 S   CT   _C5_    67     1.52808   111.40957   179.17742
   64    63 S   HC   _H6_    68     1.09623   109.87125   -58.19187
   65    63 S   HC   _H7_    69     1.09614   109.87411    59.60257
   66    61 S   CA   _C14    56     1.39828   121.21509     0.02798
   67    66 S   HA   _H15    57     1.08336   121.73316  -180.00000
   68    63 S   CT   _C4_    70     1.52044   111.40734  -179.21516
   69    68 S   HC   _H3_    71     1.09467   111.00423   -60.20306
   70    68 S   HC   _H4_    72     1.09446   110.26583  -179.96044
   71    68 S   HC   _H5_    73     1.09479   110.98692    60.29806
   72    47 S   C56A _C15    58     1.39009   105.62536   179.45320
   73    72 S   OA   _O33    59     1.36152   110.48853    -0.00000
  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  12   9   4  10   3   5   3  12   3   2  11  11
   1   1   8   4  11   6   5   6   3  10   5   4   5   3   6   5
   4   3   2   3   2   1   1   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    42    45    46    49    50    40    41    44  
   35    36  
   36  
    0  
   38    39    42    43    45    49    50    40    41    44    47    48  
   39    42    43    45    46    49    40    41    44  
   42    43    45    40  
   41    44    47    51    72    73    48    53    42    49  
   44    47    48  
   43    45    46    49    50  
   45    46    49  
   47    51    52    56    66    72    73    48    53    54    55    58  
   46    49    50  
   49    50  
   51    52    56    57    61    66    67    72    73    48    53  
   53    54    55    58    59    60    63    51    66    72    73  
   50  
    0  
   52    56    57    61    62    66    72    73  
   56    57    61    72  
   54    55    58    59    60    63    64    65    68    72    73  
   55    58    59    60    63    73  
   58    59    60    63    73  
   57    61    62    66    67    72  
   61    62    66  
   59    60    63    64    65    68    69    70    71    73  
   60    63    64    65    68  
   63    64    65    68  
   62    66    67    72    73  
   66    67    72  
   64    65    68    69    70    71  
   65    68    69    70    71  
   68    69    70    71  
   67    72    73  
   72    73  
   69    70    71  
   70    71  
   71  
    0  
   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  -0.175000   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   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760   0.154400   2.0020   1.7750   0.023028004  -0.852763146
   43   3.7500   0.6000  -0.154400   2.1120   1.8750   0.001000000  -0.848554734
   44   3.5500   0.0700  -0.272700   2.5000   1.7750   0.001000000  -0.843144165
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700   0.258100   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.136300   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0760   0.154400   2.0020   1.7750   0.023028004  -0.852763146
   50   3.7500   0.6000  -0.154400   2.1120   1.8750   0.001000000  -0.848554734
   51   3.5500   0.0700  -0.303800   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.193000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700  -0.192500   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.157100   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.122800   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.149800   1.3810   1.2100   0.030040813   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   3.5500   0.0700  -0.324500   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.195500   1.3810   1.2100   0.030040813   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700   0.323000   2.5000   1.7750   0.001000000  -0.843144165
   73   3.0000   0.1700  -0.311500   1.7000   1.5000   0.001000000  -0.126889456
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   240.000  1.763
   33    37   380.000  1.444
   33    49   549.000  1.340
   37    38   380.000  1.444
   37    40   465.000  1.376
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   100.000  2.157
   42    45   320.000  1.462
   45    46   570.000  1.229
   45    49   320.000  1.462
   49    50   100.000  2.157
   40    41   745.000  1.250
   40    44   320.000  1.460
   44    47   380.000  1.440
   44    48   520.000  1.370
   47    51   469.000  1.404
   47    72   447.000  1.419
   51    52   367.000  1.080
   51    56   469.000  1.400
   56    57   367.000  1.080
   56    61   469.000  1.400
   61    62   367.000  1.080
   61    66   469.000  1.400
   66    67   367.000  1.080
   66    72   469.000  1.400
   72    73   425.000  1.380
   73    48   340.000  1.360
   48    53   295.000  1.489
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    49    65.00000  122.11800
   33    37    38    70.00000  123.01800
   33    37    40    70.00000  117.34000
   33    49    45    65.00000  118.96000
   33    49    50    60.00000  117.48000
   37    38    39    35.00000  120.00000
   37    38    42    70.00000  123.01800
   37    40    41    65.00000  137.10300
   37    40    44    60.00000  123.20500
   38    42    43    60.00000  117.48000
   38    42    45    65.00000  118.96000
   42    38    39    35.00000  120.00000
   42    45    46    80.00000  123.72100
   42    45    49    65.00000  118.65900
   45    42    43    60.00000  117.00000
   45    49    50    60.00000  117.00000
   49    33    37    70.00000  123.01800
   49    45    46    80.00000  123.72100
   40    37    38    70.00000  117.34000
   40    44    47    65.00000  117.00000
   40    44    48    65.00000  117.00000
   44    40    41    85.00000  114.86500
   44    47    51    50.00000  134.85500
   44    47    72    80.00000  107.43600
   44    48    73    70.00000  108.00000
   44    48    53    55.00000  130.44200
   47    51    52    35.00000  120.00000
   47    51    56    63.00000  120.00000
   47    72    66    85.00000  122.70000
   47    72    73   100.00000  108.43400
   51    56    57    35.00000  120.00000
   51    56    61    63.00000  120.00000
   56    51    52    35.00000  120.00000
   56    61    62    35.00000  120.00000
   56    61    66    63.00000  120.00000
   61    56    57    35.00000  120.00000
   61    66    67    35.00000  120.00000
   61    66    72    85.00000  120.00000
   66    61    62    35.00000  120.00000
   66    72    73    70.00000  124.10000
   72    47    51    85.00000  116.20000
   72    66    67    35.00000  120.00000
   72    73    48   110.00000  105.28000
   73    48    53    80.00000  116.10000
   48    44    47    80.00000  105.82900
   48    53    54    45.00000  110.47400
   48    53    55    45.00000  110.47400
   48    53    58    70.00000  113.44400
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    63    58.35000  112.70000
   55    53    54    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    37.50000  110.70000
   58    63    64    37.50000  110.70000
   58    63    65    37.50000  110.70000
   58    63    68    58.35000  112.70000
   60    58    59    33.00000  107.80000
   63    58    59    37.50000  110.70000
   63    58    60    37.50000  110.70000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    71    37.50000  110.70000
   65    63    64    33.00000  107.80000
   68    63    64    37.50000  110.70000
   68    63    65    37.50000  110.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    49   1.00000 -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  -0.18600  1.0 3.0
   29    33    37    40  -0.18600  1.0 3.0
   29    33    49    45   7.00000 -1.0 2.0
   29    33    49    50   7.00000 -1.0 2.0
   33    37    38    39  -0.18600  1.0 3.0
   33    37    38    42   0.28850  1.0 1.0
   33    37    38    42   2.61350 -1.0 2.0
   33    37    38    42   0.78400  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    44   7.00000 -1.0 2.0
   37    33    49    45   7.00000 -1.0 2.0
   37    33    49    50   7.00000 -1.0 2.0
   37    38    42    43   7.00000 -1.0 2.0
   37    38   -42    45   7.00000 -1.0 2.0
   37    40    44    47   0.15800  1.0 1.0
   37    40    44    47   1.85350 -1.0 2.0
   37    40    44    47  -0.48700  1.0 3.0
   37    40    44    48   0.15800  1.0 1.0
   37    40    44    48   1.85350 -1.0 2.0
   37    40    44    48  -0.48700  1.0 3.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    44   7.00000 -1.0 2.0
   38    42    45    46   1.00000 -1.0 2.0
   38    42    45    49  -1.18350  1.0 1.0
   38    42    45    49   1.45950 -1.0 2.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    45   7.00000 -1.0 2.0
   42    45   -49    33  -1.18350  1.0 1.0
   42    45   -49    33   1.45950 -1.0 2.0
   42    45    49    50   1.50000 -1.0 2.0
   43    42    45    46  -0.52200  1.0 1.0
   43    42    45    46   0.82950 -1.0 2.0
   43    42    45    49   1.50000 -1.0 2.0
   46    45    49    33   1.00000 -1.0 2.0
   46    45    49    50  -0.52200  1.0 1.0
   46    45    49    50   0.82950 -1.0 2.0
   49    33   -37    38   0.28850  1.0 1.0
   49    33   -37    38   2.61350 -1.0 2.0
   49    33   -37    38   0.78400  1.0 3.0
   49    33    37    40   0.28850  1.0 1.0
   49    33    37    40   2.61350 -1.0 2.0
   49    33    37    40   0.78400  1.0 3.0
   40    37    38    39  -0.18600  1.0 3.0
   40    37    38    42   0.28850  1.0 1.0
   40    37    38    42   2.61350 -1.0 2.0
   40    37    38    42   0.78400  1.0 3.0
   40    44    47    51   3.62500 -1.0 2.0
   40    44    47    72   3.62500 -1.0 2.0
   40    44    48    73   3.62500 -1.0 2.0
   40    44    48    53   3.62500 -1.0 2.0
   41    40    44    47  -0.01750  1.0 1.0
   41    40    44    47  -0.32000 -1.0 2.0
   41    40    44    47   0.00600  1.0 3.0
   41    40    44    48  -0.01750  1.0 1.0
   41    40    44    48  -0.32000 -1.0 2.0
   41    40    44    48   0.00600  1.0 3.0
   44    47    51    52   3.62500 -1.0 2.0
   44    47    51    56   3.62500 -1.0 2.0
   44    47    72    66   3.00000 -1.0 2.0
   44    47   -72    73   3.62500 -1.0 2.0
   44    48    53    54   0.00000  1.0 1.0
   44    48    53    55   0.00000  1.0 1.0
   44    48    53    58   0.04150 -1.0 2.0
   47    44   -48    73   3.62500 -1.0 2.0
   47    44    48    53   3.62500 -1.0 2.0
   47    51    56    57   3.62500 -1.0 2.0
   47    51    56    61   3.62500 -1.0 2.0
   47    72   -73    48   3.62500 -1.0 2.0
   51    47    72    66   3.00000 -1.0 2.0
   51    47    72    73   3.62500 -1.0 2.0
   51    56    61    62   3.62500 -1.0 2.0
   51    56   -61    66   3.62500 -1.0 2.0
   52    51    56    57   3.62500 -1.0 2.0
   52    51    56    61   3.62500 -1.0 2.0
   56    61    66    67   3.62500 -1.0 2.0
   56    61    66    72   3.62500 -1.0 2.0
   57    56    61    62   3.62500 -1.0 2.0
   57    56    61    66   3.62500 -1.0 2.0
   61    66   -72    47   3.62500 -1.0 2.0
   61    66    72    73   3.62500 -1.0 2.0
   62    61    66    67   3.62500 -1.0 2.0
   62    61    66    72   3.62500 -1.0 2.0
   66    72    73    48   3.62500 -1.0 2.0
   67    66    72    47   3.62500 -1.0 2.0
   67    66    72    73   3.62500 -1.0 2.0
   72    47    51    52   3.50000 -1.0 2.0
   72    47   -51    56   3.50000 -1.0 2.0
   72    73   -48    44   3.62500 -1.0 2.0
   72    73    48    53   3.62500 -1.0 2.0
   73    48    53    54   0.00000  1.0 1.0
   73    48    53    55   0.00000  1.0 1.0
   73    48    53    58   0.38650  1.0 1.0
   73    48    53    58  -0.24750 -1.0 2.0
   73    48    53    58   0.76750  1.0 3.0
   48    44    47    51   3.62500 -1.0 2.0
   48    44   -47    72   3.50000 -1.0 2.0
   48    53    58    59   0.43200  1.0 3.0
   48    53    58    60   0.43200  1.0 3.0
   48    53    58    63  -0.03700  1.0 1.0
   48    53    58    63   0.37200 -1.0 2.0
   48    53    58    63  -0.47300  1.0 3.0
   53    58    63    64   0.15000  1.0 3.0
   53    58    63    65   0.15000  1.0 3.0
   53    58    63    68   0.56750  1.0 1.0
   53    58    63    68  -0.07550 -1.0 2.0
   53    58    63    68   0.20000  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    63   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    63   0.15000  1.0 3.0
   58    63    68    69   0.15000  1.0 3.0
   58    63    68    70   0.15000  1.0 3.0
   58    63    68    71   0.15000  1.0 3.0
   59    58    63    64   0.15000  1.0 3.0
   59    58    63    65   0.15000  1.0 3.0
   59    58    63    68   0.15000  1.0 3.0
   60    58    63    64   0.15000  1.0 3.0
   60    58    63    65   0.15000  1.0 3.0
   60    58    63    68   0.15000  1.0 3.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    70   0.15000  1.0 3.0
   64    63    68    71   0.15000  1.0 3.0
   65    63    68    69   0.15000  1.0 3.0
   65    63    68    70   0.15000  1.0 3.0
   65    63    68    71   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   29    37    33    49   1.10000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   37    39    38    42   1.10000 -1.0 2.0
   45    43    42    38   1.10000 -1.0 2.0
   42    49    45    46  10.50000 -1.0 2.0
   45    50    49    33   1.10000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   47    48    44    40   4.00000 -1.0 2.0
   51    72    47    44   4.00000 -1.0 2.0
   56    52    51    47   1.10000 -1.0 2.0
   61    57    56    51   1.10000 -1.0 2.0
   66    62    61    56   1.10000 -1.0 2.0
   72    67    66    61   1.10000 -1.0 2.0
   66    73    72    47   4.00000 -1.0 2.0
   73    53    48    44   4.00000 -1.0 2.0
END
