* LIGAND DATABASE FILE (OPLS2005)
*
001      67    69    118    185     343
    1     0 S   NP   _N1_     1    28.59176    95.64801   -24.84504
    2     1 S   H    _HN1     2     1.02958    73.44119    10.67402
    3     1 S   H    _H1_     3     1.02835    33.78475  -175.42611
    4     1 S   H    _H2_     4     1.02776   116.03921   -92.04162
    5     1 S   CT   _CA1     5     1.50131   127.12426   114.01311
    6     5 S   HC   _HA1     6     1.09576   105.21202    93.27814
    7     5 S   CO3  _C1_     7     1.53786   112.38064   -26.91123
    8     7 S   O2Z  _O11     8     1.26367   114.99284   -43.38771
    9     7 S   O2Z  _O12     9     1.26236   114.93489   135.71045
   10     5 S   CT   _CB1    10     1.53096   107.42184  -148.80062
   11    10 S   HC   HB11    11     1.09827   109.33147   -50.39432
   12    10 S   HC   HB12    12     1.09817   110.42520    66.16588
   13    10 S   CT   _CG1    13     1.53018   112.67292  -171.45918
   14    13 S   HC   HG11    14     1.09593   110.49706   -64.54789
   15    13 S   HC   HG12    15     1.09658   109.90977    54.65448
   16    13 S   C    _CD1    16     1.51844   112.32086   175.02390
   17    16 S   O    _OE1    17     1.22749   123.28177     0.70969
   18    16 S   N    _N2_    18     1.38563   111.70067  -179.31101
   19    18 S   H    _HN2    19     1.01555   118.99556     4.59321
   20    18 S   CT1  _CA2    20     1.45812   122.89376   177.82031
   21    20 S   HC   _HA2    21     1.09740   108.93825    23.56805
   22    20 S   C    _C2_    22     1.52921   107.19208   -93.39107
   23    22 S   O    _O2_    23     1.22981   123.00161   -27.21938
   24    20 S   CT   _CB2    32     1.53160   112.14222   146.74260
   25    24 S   HC   HB21    33     1.09586   110.54570    52.01436
   26    24 S   HC   HB22    34     1.09337   109.53648   170.96845
   27    22 S   N    _N3_    24     1.38563   112.58172   155.48216
   28    27 S   H    _HN3    25     1.01694   120.32729    -1.64330
   29    24 S   S    _SG2    35     1.82588   110.93961   -68.86132
   30    27 S   CT   _CA3    26     1.45362   122.40308   178.53647
   31    30 S   HC   HA31    27     1.09573   107.56050   -59.35616
   32    30 S   HC   HA32    28     1.09562   107.80250    56.90353
   33    29 S   CT   _C10    36     1.82821   100.10991   176.37609
   34    33 S   HC   _H3_    37     1.09534   109.56997   -53.83604
   35    30 S   CO3  _C3_    29     1.52882   114.46175   178.68612
   36    35 S   O2Z  _O31    30     1.26311   116.11893    -6.51951
   37    35 S   O2Z  _O32    31     1.26447   114.42109   173.57764
   38    33 S   CM   _C5_    38     1.50758   109.65451  -174.02388
   39    38 S   CMA  _C6_    39     1.35422   123.57301   -98.10308
   40    39 S   OM   _O38    40     1.26080   131.61698   178.21403
   41    38 S   OS   _O33    63     1.38972   114.96220    79.21870
   42    39 S   CM   _C7_    41     1.46443   117.73436    -0.38052
   43    42 S   HC   _H7_    42     1.09148   117.41414   166.04992
   44    41 S   CT   _C4_    64     1.42619   110.87083    89.43366
   45    44 S   HC   _H4_    65     1.09399   107.86471   178.96789
   46    44 S   HC   _H5_    66     1.09517   111.31363    60.58767
   47    44 S   HC   _H6_    67     1.09478   111.26225   -62.71571
   48    42 S   CM   _C8_    43     1.34504   124.34357   -13.61680
   49    48 S   CM   _C11    44     1.45088   123.75170   179.62727
   50    33 S   CO4  _C9_    61     1.51908   109.94246    64.54101
   51    50 S   O    _O34    62     1.23189   121.43291   -91.94411
   52    49 S   CM   _C12    45     1.34137   122.95349    57.60931
   53    52 S   HC   _H8_    46     1.08334   123.70869    -0.51129
   54    49 S   CO4  _C19    57     1.49032   119.94258  -123.09131
   55    54 S   O    _O36    58     1.22452   122.56630     4.48926
   56    52 S   OS   _O35    47     1.37371   126.91810   178.83467
   57    56 S   CA   _C13    48     1.37144   117.63175    -2.32355
   58    57 S   CA   _C14    49     1.39475   117.25952  -177.63313
   59    58 S   HA   _H9_    50     1.08649   120.39477     0.04423
   60    58 S   CA   _C15    51     1.39330   119.35820   179.91153
   61    60 S   CA   _C16    52     1.39451   120.93552     0.11703
   62    61 S   HA   _H10    53     1.08630   121.03895  -179.92087
   63    60 S   OH   _O37    59     1.36656   118.12008  -179.86583
   64    63 S   HO   _H12    60     0.97258   108.53393   179.53103
   65    61 S   CA   _C17    54     1.39531   119.57415     0.05234
   66    65 S   HA   _H11    55     1.08676   119.16573   179.96044
   67    57 S   CA   _C18    56     1.39449   122.65413     2.44489
  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   8   5   4   3
  11   6   2   1   1  12   8   4   6   7   3   3   2   1   1   9
  10   3   1   7   3   8   3   6   8   8   4   7   6   4   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    50    51    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    48    49    50    51    41    44  
   38    39    48    50    51    41  
   36    37  
   37  
    0  
   39    40    42    43    48    50    51    41    44    45    46    47  
   40    42    43    48    49    50    41    44  
   42    43    48    41  
   44    45    46    47    42    50  
   43    48    49    52    54    50    51  
   48    49    50  
   45    46    47  
   46    47  
   47  
    0  
   49    52    53    56    67    54    55    50    51  
   52    53    56    57    65    67    54    55    50    51  
   51    52    54  
    0  
   53    56    57    58    67    54    55  
   56    57    54  
   55    56    57    58    61    65    66    67  
   57    65    67  
   57    58    59    60    65    67  
   58    59    60    61    65    66    67    63  
   59    60    61    62    65    67    63    64  
   60    61    67    63  
   61    62    65    66    67    63    64  
   62    65    66    67    63    64  
   65    66    67    63  
   64    65  
    0  
   66    67  
   67  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   52   3.5500   0.0760  -0.030000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   56   2.8500   0.1400  -0.170000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    50   317.000  1.522
   38    39   465.000  1.376
   38    41   440.000  1.360
   39    40   745.000  1.250
   39    42   465.000  1.376
   42    43   340.000  1.080
   42    48   549.000  1.340
   48    49   380.000  1.444
   48    50   320.000  1.462
   49    52   549.000  1.340
   49    54   320.000  1.462
   52    53   340.000  1.080
   52    56   440.000  1.360
   56    57   450.000  1.364
   57    58   469.000  1.400
   57    67   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   469.000  1.400
   60    63   450.000  1.364
   61    62   367.000  1.080
   61    65   469.000  1.400
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    54   310.000  1.470
   54    55   570.000  1.229
   63    64   553.000  0.945
   50    51   570.000  1.229
   41    44   320.000  1.410
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    50    75.00000  110.18000
   33    38    39    70.00000  124.00000
   33    38    41    85.00000  112.85300
   33    50    48    65.00000  118.62400
   33    50    51    80.00000  120.40000
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  137.10300
   38    39    42    70.00000  123.01800
   38    41    44    90.00000  111.18400
   39    42    43    40.00000  120.50800
   39    42    48    70.00000  117.34000
   42    39    40    65.00000  137.10300
   42    48    49    60.00000  124.00000
   42    48    50    65.00000  118.96000
   48    42    43    35.00000  120.00000
   48    49    52    60.00000  124.00000
   48    49    54    60.00000  124.00000
   48    50    51    80.00000  123.72100
   49    52    53    35.00000  120.00000
   49    52    56    80.00000  120.01400
   49    54    67    65.00000  117.02400
   49    54    55    80.00000  123.72100
   52    56    57    90.00000  114.30300
   56    52    53    55.00000  109.52600
   56    57    58    70.00000  120.00000
   56    57    67    70.00000  120.00000
   57    58    59    35.00000  120.00000
   57    58    60    63.00000  120.00000
   57    67    65    63.00000  120.00000
   57    67    54    60.00000  119.52600
   58    60    61    63.00000  120.00000
   58    60    63    70.00000  120.00000
   60    58    59    35.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    65    63.00000  120.00000
   60    63    64    35.00000  113.00000
   61    65    66    35.00000  120.00000
   61    65    67    63.00000  120.00000
   65    61    62    35.00000  120.00000
   65    67    54    60.00000  119.52600
   67    57    58    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    54    55    75.00000  123.78400
   54    49    52    65.00000  118.96000
   63    60    61    70.00000  120.00000
   50    33    34    35.00000  109.50000
   50    33    38    70.00000  109.06800
   50    48    49    60.00000  124.00000
   41    38    39    80.00000  120.01400
   41    44    45    35.00000  109.50000
   41    44    46    35.00000  109.50000
   41    44    47    35.00000  109.50000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.09700  1.0 1.0
   29    33    38    41   0.15600 -1.0 2.0
   29    33    38    41  -0.50800  1.0 3.0
   29    33    50    48   0.65300  1.0 1.0
   29    33    50    48  -0.03850 -1.0 2.0
   29    33    50    48   0.33900  1.0 3.0
   29    33    50    51   0.30150 -1.0 2.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    41    44   2.00000 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    50    48   0.00000  1.0 1.0
   34    33    50    51   0.00000  1.0 1.0
   38    33    50    48   0.65300  1.0 1.0
   38    33    50    48  -0.03850 -1.0 2.0
   38    33    50    48   0.33900  1.0 3.0
   38    33    50    51   0.30150 -1.0 2.0
   38    39    42    43   7.00000 -1.0 2.0
   38    39   -42    48   7.00000 -1.0 2.0
   38    41    44    45   0.08050  1.0 3.0
   38    41    44    46   0.08050  1.0 3.0
   38    41    44    47   0.08050  1.0 3.0
   39    38    41    44  -2.26850  1.0 1.0
   39    38    41    44   3.39050 -1.0 2.0
   39    42    48    49   7.00000 -1.0 2.0
   39    42    48    50   7.00000 -1.0 2.0
   40    39    42    43   7.00000 -1.0 2.0
   40    39    42    48   7.00000 -1.0 2.0
   42    48    49    52   0.28850  1.0 1.0
   42    48    49    52   2.61350 -1.0 2.0
   42    48    49    52   0.78400  1.0 3.0
   42    48    49    54  -0.18600  1.0 3.0
   42    48   -50    33  -0.33500  1.0 1.0
   42    48   -50    33   1.06600 -1.0 2.0
   42    48   -50    33  -0.14000  1.0 3.0
   42    48    50    51   1.00000 -1.0 2.0
   43    42    48    49   7.00000 -1.0 2.0
   43    42    48    50   7.00000 -1.0 2.0
   48    49    52    53   7.00000 -1.0 2.0
   48    49    52    56   7.00000 -1.0 2.0
   48    49    54    67  -1.65800  1.0 1.0
   48    49    54    67   0.77650 -1.0 2.0
   48    49    54    55   1.00000 -1.0 2.0
   49    48    50    33  -0.33500  1.0 1.0
   49    48    50    33   1.06600 -1.0 2.0
   49    48    50    33  -0.14000  1.0 3.0
   49    48    50    51   1.00000 -1.0 2.0
   49    52    56    57   2.00000 -1.0 2.0
   52    49    54    67  -1.65800  1.0 1.0
   52    49    54    67   0.77650 -1.0 2.0
   52    49    54    55   1.00000 -1.0 2.0
   52    56    57    58   0.00000  1.0 1.0
   52    56   -57    67   0.00000  1.0 1.0
   53    52    56    57   0.50000 -1.0 2.0
   56    57    58    59   3.62500 -1.0 2.0
   56    57    58    60   3.62500 -1.0 2.0
   56    57    67    65   3.62500 -1.0 2.0
   56    57    67    54   3.62500 -1.0 2.0
   57    58    60    61   3.62500 -1.0 2.0
   57    58    60    63   3.62500 -1.0 2.0
   57    67   -54    49  -0.11500  1.0 1.0
   57    67   -54    49   1.10450 -1.0 2.0
   57    67   -54    49  -0.48050  1.0 3.0
   57    67    54    55   1.05000 -1.0 2.0
   58    57    67    65   3.62500 -1.0 2.0
   58    57    67    54   3.62500 -1.0 2.0
   58    60    61    62   3.62500 -1.0 2.0
   58    60   -61    65   3.62500 -1.0 2.0
   58    60    63    64   0.84100 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    63   3.62500 -1.0 2.0
   60    61    65    66   3.62500 -1.0 2.0
   60    61    65    67   3.62500 -1.0 2.0
   61    60    63    64   0.84100 -1.0 2.0
   61    65   -67    57   3.62500 -1.0 2.0
   61    65    67    54   3.62500 -1.0 2.0
   62    61    65    66   3.62500 -1.0 2.0
   62    61    65    67   3.62500 -1.0 2.0
   65    67    54    49  -0.11500  1.0 1.0
   65    67    54    49   1.10450 -1.0 2.0
   65    67    54    49  -0.48050  1.0 3.0
   65    67    54    55   1.05000 -1.0 2.0
   66    65    67    57   3.62500 -1.0 2.0
   66    65    67    54   3.62500 -1.0 2.0
   67    57    58    59   3.62500 -1.0 2.0
   67    57   -58    60   3.62500 -1.0 2.0
   54    49    52    53   7.00000 -1.0 2.0
   54    49   -52    56   7.00000 -1.0 2.0
   63    60    61    62   3.62500 -1.0 2.0
   63    60    61    65   3.62500 -1.0 2.0
   50    33   -38    39  -0.51250  1.0 1.0
   50    33   -38    39  -0.88800 -1.0 2.0
   50    33   -38    39   0.08850  1.0 3.0
   50    33    38    41   0.09700  1.0 1.0
   50    33    38    41   0.15600 -1.0 2.0
   50    33    38    41  -0.50800  1.0 3.0
   50    48    49    52  -0.18600  1.0 3.0
   50    48    49    54   1.08500 -1.0 2.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    42   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    41    38    39   1.10000 -1.0 2.0
   42    40    39    38   1.10000 -1.0 2.0
   39    43    42    48   1.10000 -1.0 2.0
   49    50    48    42   1.10000 -1.0 2.0
   48    54    49    52   1.10000 -1.0 2.0
   56    53    52    49   1.10000 -1.0 2.0
   58    67    57    56   4.00000 -1.0 2.0
   60    59    58    57   1.10000 -1.0 2.0
   61    63    60    58   4.00000 -1.0 2.0
   65    62    61    60   1.10000 -1.0 2.0
   67    66    65    61   1.10000 -1.0 2.0
   65    54    67    57   4.00000 -1.0 2.0
   49    67    54    55  10.50000 -1.0 2.0
   33    48    50    51  10.50000 -1.0 2.0
END
