* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    128    203     375
    1     0 S   NP   _N1_     1    28.82226    95.96706   -24.41904
    2     1 S   H    _HN1     2     1.02828    34.04697   177.33230
    3     1 S   H    _H1_     3     1.02795   113.56354   -95.37307
    4     1 S   H    _H2_     4     1.02947    73.59550     7.91949
    5     1 S   CT   _CA1     5     1.50125   129.61113   111.13648
    6     5 S   HC   _HA1     6     1.09573   105.16554    92.50728
    7     5 S   CO3  _C1_     7     1.53773   112.44033   -27.70831
    8     7 S   O2Z  _O11     8     1.26377   115.00843   -43.05944
    9     7 S   O2Z  _O12     9     1.26234   114.94466   135.94084
   10     5 S   CT   _CB1    10     1.53057   107.40236  -149.52758
   11    10 S   HC   HB11    11     1.09841   109.34844   -49.31639
   12    10 S   HC   HB12    12     1.09810   110.47287    67.28279
   13    10 S   CT   _CG1    13     1.53016   112.63081  -170.24397
   14    13 S   HC   HG11    14     1.09571   110.72332   -66.92494
   15    13 S   HC   HG12    15     1.09669   109.71003    52.32595
   16    13 S   C    _CD1    16     1.51811   111.99917   172.81586
   17    16 S   O    _OE1    17     1.22756   123.17679    11.76450
   18    16 S   N    _N2_    18     1.38629   111.82857  -168.26061
   19    18 S   H    _HN2    19     1.01574   119.02727     1.12204
   20    18 S   CT1  _CA2    20     1.46231   123.41182   177.06015
   21    20 S   HC   _HA2    21     1.09742   109.27956     8.13687
   22    20 S   C    _C2_    22     1.53687   108.96028  -107.43411
   23    22 S   O    _O2_    23     1.23093   122.21972  -148.94361
   24    20 S   CT   _CB2    32     1.53449   111.57939   130.13713
   25    24 S   HC   HB21    33     1.09491   109.61150    57.19112
   26    24 S   HC   HB22    34     1.09385   109.50415   175.95853
   27    22 S   N    _N3_    24     1.38307   113.90472    38.56134
   28    27 S   H    _HN3    25     1.01538   119.61621    -3.13494
   29    24 S   S    _SG2    35     1.83242   111.06900   -64.54918
   30    27 S   CT   _CA3    26     1.45278   123.27208   177.21449
   31    30 S   HC   HA31    27     1.09547   107.50593   -65.03572
   32    30 S   HC   HA32    28     1.09556   108.00491    51.42200
   33    29 S   CT   _C6_    36     1.89662   102.38513   170.76954
   34    33 S   OM   _O35    37     1.32644   107.99757   -62.51530
   35    30 S   CO3  _C3_    29     1.52973   114.04756   173.43935
   36    35 S   O2Z  _O31    30     1.26382   116.08223    -0.14127
   37    35 S   O2Z  _O32    31     1.26425   114.41517   179.91607
   38    33 S   CA   _C7_    38     1.54612   110.46730  -178.48871
   39    33 S   CT   _C5_    52     1.56968   108.66990    55.47204
   40    39 S   HC   _H3_    53     1.10051   108.67643   -69.05923
   41    38 S   CA   _C8_    39     1.41707   120.41949    40.59324
   42    41 S   HA   _H7_    40     1.08806   120.61402     0.47437
   43    39 S   C    _C13    54     1.54135   114.98097    51.49117
   44    43 S   O    _O36    55     1.22803   122.20667    31.10858
   45    41 S   CA   _C9_    41     1.39897   122.34110   179.54803
   46    45 S   HA   _H8_    42     1.08623   119.80398   179.55063
   47    43 S   N    _N5_    56     1.39009   111.72520  -149.13880
   48    47 S   H    _H11    57     1.01561   118.48037     0.98536
   49    45 S   CA   _C10    43     1.38764   120.08023    -0.93503
   50    49 S   HA   _H9_    44     1.08565   120.26166  -179.84549
   51    47 S   CA   _C14    58     1.41061   128.37134  -179.20352
   52    49 S   CA   _C11    45     1.38944   119.48144    -0.78634
   53    52 S   HA   _H10    46     1.08729   119.00295  -178.74041
   54    51 S   CA   _C15    59     1.39078   123.53769     0.50007
   55    54 S   HA   _H12    60     1.08223   123.18117     0.08393
   56    38 S   CA   _C12    47     1.40878   123.80441  -142.60744
   57    54 S   CA   _C16    61     1.39510   118.78164   180.00000
   58    57 S   HA   _H13    62     1.08634   119.90646  -179.98022
   59    56 S   SY   _S1_    48     1.76414   122.70796    -1.22717
   60    59 S   OY   _O33    49     1.44978   107.03021   108.27453
   61    59 S   OY   _O34    50     1.45110   107.00804  -121.30431
   62    57 S   CA   _C17    63     1.38704   120.00338    -0.00000
   63    62 S   HA   _H14    64     1.08364   121.20705   179.97202
   64    59 S   NS   _N4_    51     1.69784   103.08931    -7.31842
   65    62 S   CA   _C18    65     1.38102   117.54379    -0.02798
   66    65 S   HA   _H15    66     1.08513   120.92140  -179.97202
   67    51 S   NB   _N6_    67     1.35691   114.62274  -179.59170
   68    64 S   CT   _C4_    68     1.47887   116.96210  -174.62524
   69    68 S   HC   _H4_    69     1.09403   110.00746    52.10798
   70    68 S   HC   _H5_    70     1.09305   110.85353   -68.64054
   71    68 S   HC   _H6_    71     1.09405   110.57768   170.23121
  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   9   5   4   3
  15   7   2   1   1  15  16   6   8   4   9   4   6   3   8   3
   5   3   8   6   2   7   4   5   6   3   7   3   2   4   3   4
   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    56    64    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    56    59    64    39    40    43    44    47    68  
   38    41    56    64    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    49    52    53    56    59    60    61    64    39    40    43  
   40    43    44    47    48    51    68    69    70    71    41    56    59    60    61    64  
   43    44    47    68    59    64  
   42    45    46    49    50    52    56    59  
   45    46    49    56  
   44    47    48    51    54    67    68    59    64  
   47    48    51    64  
   46    49    50    52    53    56  
   49    50    52  
   48    51    54    55    57    65    67    64  
   51    54    67  
   50    52    53    56    59  
   52    53    56  
   54    55    57    58    62    65    66    67  
   53    56    59    60    61    64  
   56    59  
   55    57    58    62    63    65    67  
   57    58    62    67  
   59    60    61    64    68  
   58    62    63    65    66    67  
   62    63    65  
   60    61    64    68    69    70    71  
   61    64    68  
   64    68  
   63    65    66    67  
   65    66    67  
   68    69    70    71  
   66    67  
   67  
    0  
   69    70    71  
   70    71  
   71  
    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   4.2000   0.3000   0.102500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.168800   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   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  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   48   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700   0.570000   2.0020   1.7750   0.001000000  -0.843144165
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700   0.227000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.065000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   60   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   61   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   64   3.2500   0.1700  -0.537600   1.8100   1.6000   0.054801302  -1.445846770
   65   3.5500   0.0700   0.473000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.012000   1.3810   1.2100   0.030040813   0.268726247
   67   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   68   3.5000   0.0660   0.022200   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   570.000  1.307
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    56   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   367.000  1.080
   49    52   469.000  1.400
   52    53   367.000  1.080
   52    56   469.000  1.400
   56    59   225.000  1.779
   59    60   735.000  1.471
   59    61   735.000  1.471
   59    64   245.000  1.722
   64    39   300.000  1.458
   64    68   300.000  1.458
   39    40   340.000  1.090
   39    43   317.000  1.522
   43    44   570.000  1.229
   43    47   490.000  1.335
   47    48   434.000  1.010
   47    51   360.000  1.404
   51    54   469.000  1.400
   51    67   483.000  1.339
   54    55   367.000  1.080
   54    57   469.000  1.400
   57    58   367.000  1.080
   57    62   469.000  1.400
   62    63   367.000  1.080
   62    65   469.000  1.400
   65    66   367.000  1.080
   65    67   483.000  1.339
   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    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    85.00000  114.68000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    56    70.00000  120.00000
   33    39    64    80.00000  110.21000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   38    33    34    85.00000  111.85700
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    56    52    63.00000  120.00000
   38    56    59    65.00000  117.06700
   41    45    46    35.00000  120.00000
   41    45    49    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    52    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    52    53    35.00000  120.00000
   49    52    56    63.00000  120.00000
   52    49    50    35.00000  120.00000
   52    56    59    65.00000  117.06700
   56    38    41    63.00000  120.00000
   56    52    53    35.00000  120.00000
   56    59    60   100.00000  107.67100
   56    59    61   100.00000  107.67100
   56    59    64    95.00000  101.59200
   59    64    39    75.00000  117.08200
   59    64    68    75.00000  117.08200
   61    59    60   115.00000  120.17200
   64    59    60   115.00000  107.22500
   64    59    61   115.00000  107.22500
   64    39    40    50.00000  109.35000
   64    39    43    75.00000  113.79000
   64    68    69    50.00000  109.35000
   64    68    70    50.00000  109.35000
   64    68    71    50.00000  109.35000
   39    33    34    50.00000  109.50000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    47    70.00000  116.60000
   43    39    40    35.00000  109.50000
   43    47    48    35.00000  119.80000
   43    47    51    65.00000  121.96500
   47    43    44    80.00000  122.90000
   47    51    54    70.00000  119.01900
   47    51    67    75.00000  123.00000
   51    47    48    45.00000  118.23600
   51    54    55    35.00000  120.00000
   51    54    57    63.00000  120.00000
   51    67    65    70.00000  117.00000
   54    57    58    35.00000  120.00000
   54    57    62    63.00000  120.00000
   57    54    55    35.00000  120.00000
   57    62    63    35.00000  120.00000
   57    62    65    63.00000  120.00000
   62    57    58    35.00000  120.00000
   62    65    66    35.00000  120.00000
   62    65    67    70.00000  124.00000
   65    62    63    35.00000  120.00000
   67    51    54    70.00000  124.00000
   67    65    66    35.00000  116.00000
   68    64    39    75.00000  112.87000
   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   0.01700  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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    56  -0.16000  1.0 1.0
   29    33    38    56  -0.03200 -1.0 2.0
   29    33    38    56   0.04500  1.0 3.0
   29    33    39    64   0.56750  1.0 1.0
   29    33    39    64  -0.07550 -1.0 2.0
   29    33    39    64   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    56    52   3.62500 -1.0 2.0
   33    38    56    59   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    47   1.39750  1.0 1.0
   33    39    43    47  -0.07950 -1.0 2.0
   33    39    43    47  -0.18750  1.0 3.0
   34    33    38    41   0.64500  1.0 1.0
   34    33    38    41   0.14800 -1.0 2.0
   34    33    38    41   0.20650  1.0 3.0
   34    33    38    56   0.64500  1.0 1.0
   34    33    38    56   0.14800 -1.0 2.0
   34    33    38    56   0.20650  1.0 3.0
   34    33    39    64   1.74050  1.0 1.0
   34    33    39    40   0.23400  1.0 3.0
   34    33    39    43  -0.09450  1.0 1.0
   34    33    39    43  -1.12950 -1.0 2.0
   34    33    39    43   0.54000  1.0 3.0
   38    33    39    64   0.83750  1.0 1.0
   38    33    39    64   0.32200 -1.0 2.0
   38    33    39    64   0.70600  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    49   3.62500 -1.0 2.0
   38    56    59    60   0.19500  1.0 1.0
   38    56    59    60   0.12000 -1.0 2.0
   38    56    59    61   0.19500  1.0 1.0
   38    56    59    61   0.12000 -1.0 2.0
   38    56   -59    64  -0.49050  1.0 1.0
   38    56   -59    64   0.22250 -1.0 2.0
   38    56   -59    64  -0.39350  1.0 3.0
   41    38    56    52   3.62500 -1.0 2.0
   41    38    56    59   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   41    45   -49    52   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
   45    49    52    53   3.62500 -1.0 2.0
   45    49    52    56   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    52   3.62500 -1.0 2.0
   49    52   -56    38   3.62500 -1.0 2.0
   49    52    56    59   3.62500 -1.0 2.0
   50    49    52    53   3.62500 -1.0 2.0
   50    49    52    56   3.62500 -1.0 2.0
   52    56    59    60   0.19500  1.0 1.0
   52    56    59    60   0.12000 -1.0 2.0
   52    56    59    61   0.19500  1.0 1.0
   52    56    59    61   0.12000 -1.0 2.0
   52    56    59    64  -0.49050  1.0 1.0
   52    56    59    64   0.22250 -1.0 2.0
   52    56    59    64  -0.39350  1.0 3.0
   53    52    56    38   3.62500 -1.0 2.0
   53    52    56    59   3.62500 -1.0 2.0
   56    38    41    42   3.62500 -1.0 2.0
   56    38   -41    45   3.62500 -1.0 2.0
   56    59    64    39  -0.64500  1.0 1.0
   56    59    64    39  -1.19050 -1.0 2.0
   56    59    64    39  -0.04400  1.0 3.0
   56    59    64    68  -0.64500  1.0 1.0
   56    59    64    68  -1.19050 -1.0 2.0
   56    59    64    68  -0.04400  1.0 3.0
   59    64   -39    33  -0.71500  1.0 1.0
   59    64   -39    33  -0.42400 -1.0 2.0
   59    64   -39    33   0.18500  1.0 3.0
   59    64    39    40   0.15000  1.0 3.0
   59    64    39    43   0.23200  1.0 1.0
   59    64    39    43   0.02100 -1.0 2.0
   59    64    39    43   0.24950  1.0 3.0
   59    64    68    69   0.15000  1.0 3.0
   59    64    68    70   0.15000  1.0 3.0
   59    64    68    71   0.15000  1.0 3.0
   60    59    64    39  -0.30400  1.0 1.0
   60    59    64    39   0.50450 -1.0 2.0
   60    59    64    39   0.65550  1.0 3.0
   60    59    64    68  -0.30400  1.0 1.0
   60    59    64    68   0.50450 -1.0 2.0
   60    59    64    68   0.65550  1.0 3.0
   61    59    64    39  -0.30400  1.0 1.0
   61    59    64    39   0.50450 -1.0 2.0
   61    59    64    39   0.65550  1.0 3.0
   61    59    64    68  -0.30400  1.0 1.0
   61    59    64    68   0.50450 -1.0 2.0
   61    59    64    68   0.65550  1.0 3.0
   64    39    43    44   0.30150 -1.0 2.0
   64    39    43    47   0.00000  1.0 1.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33   -38    56   0.04150 -1.0 2.0
   39    64    68    69   0.15000  1.0 3.0
   39    64    68    70   0.15000  1.0 3.0
   39    64    68    71   0.15000  1.0 3.0
   39    43    47    48   2.45000 -1.0 2.0
   39    43    47    51   0.76000  1.0 1.0
   39    43    47    51   4.11600 -1.0 2.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    47   0.00000  1.0 1.0
   43    47    51    54   1.00100  1.0 1.0
   43    47    51    54   0.85050 -1.0 2.0
   43    47    51    67   0.96250 -1.0 2.0
   44    43    47    48   2.45000 -1.0 2.0
   44    43    47    51   0.04000 -1.0 2.0
   47    51    54    55   3.62500 -1.0 2.0
   47    51    54    57   3.62500 -1.0 2.0
   47    51    67    65   3.62500 -1.0 2.0
   48    47    51    54   0.97800 -1.0 2.0
   48    47    51    67   0.96250 -1.0 2.0
   51    54    57    58   3.62500 -1.0 2.0
   51    54    57    62   3.62500 -1.0 2.0
   54    51    67    65   3.62500 -1.0 2.0
   54    57    62    63   3.62500 -1.0 2.0
   54    57   -62    65   3.62500 -1.0 2.0
   55    54    57    58   3.62500 -1.0 2.0
   55    54    57    62   3.62500 -1.0 2.0
   57    62    65    66   3.62500 -1.0 2.0
   57    62    65    67   3.62500 -1.0 2.0
   58    57    62    63   3.62500 -1.0 2.0
   58    57    62    65   3.62500 -1.0 2.0
   62    65   -67    51   3.62500 -1.0 2.0
   63    62    65    66   3.62500 -1.0 2.0
   63    62    65    67   3.62500 -1.0 2.0
   66    65    67    51   3.62500 -1.0 2.0
   67    51    54    55   3.62500 -1.0 2.0
   67    51   -54    57   3.62500 -1.0 2.0
   68    64    39    33   0.58650  1.0 1.0
   68    64    39    33   0.12600 -1.0 2.0
   68    64    39    33   0.33350  1.0 3.0
   68    64    39    40   0.15000  1.0 3.0
   68    64    39    43  -1.76800  1.0 1.0
   68    64    39    43   1.02600 -1.0 2.0
   68    64    39    43   0.19700  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
   36    30    35    37  10.50000 -1.0 2.0
   41    56    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   52    50    49    45   1.10000 -1.0 2.0
   56    53    52    49   1.10000 -1.0 2.0
   52    59    56    38   4.00000 -1.0 2.0
   68    59    64    39   1.00000 -1.0 2.0
   39    47    43    44  10.50000 -1.0 2.0
   48    43    47    51   1.00000 -1.0 2.0
   54    67    51    47   4.00000 -1.0 2.0
   57    55    54    51   1.10000 -1.0 2.0
   62    58    57    54   1.10000 -1.0 2.0
   65    63    62    57   1.10000 -1.0 2.0
   67    66    65    62   1.10000 -1.0 2.0
END
