* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    127    206     375
    1     0 S   NP   _N1_     1    28.72898    95.38694   -20.74025
    2     1 S   H    _HN1     2     1.02960    87.77979    28.63976
    3     1 S   H    _H1_     3     1.02837    35.92102   152.20945
    4     1 S   H    _H2_     4     1.02778    86.29418   -79.89694
    5     1 S   CT   _CA1     5     1.50118   146.65808   153.80891
    6     5 S   HC   _HA1     6     1.09567   105.25498    58.17577
    7     5 S   CO3  _C1_     7     1.53790   112.39816   -62.13200
    8     7 S   O2Z  _O11     8     1.26373   114.99661   -42.60818
    9     7 S   O2Z  _O12     9     1.26232   115.00451   136.73753
   10     5 S   CT   _CB1    10     1.53115   107.44129   176.22405
   11    10 S   HC   HB11    11     1.09819   109.43645   -49.49695
   12    10 S   HC   HB12    12     1.09823   110.39442    67.12022
   13    10 S   CT   _CG1    13     1.52979   112.62886  -170.56601
   14    13 S   HC   HG11    14     1.09502   110.44505   -61.74007
   15    13 S   HC   HG12    15     1.09647   110.02162    57.33478
   16    13 S   C    _CD1    16     1.51807   112.33120   177.54234
   17    16 S   O    _OE1    17     1.22714   123.24932    -7.27459
   18    16 S   N    _N2_    18     1.38574   111.61147   173.38758
   19    18 S   H    _HN2    19     1.01597   118.95545     0.15195
   20    18 S   CT1  _CA2    20     1.46238   123.51681   179.77272
   21    20 S   HC   _HA2    21     1.09727   109.45211   -12.37908
   22    20 S   C    _C2_    22     1.53446   108.19618  -128.03225
   23    22 S   O    _O2_    23     1.23012   122.25590  -145.71943
   24    20 S   CT   _CB2    32     1.53299   111.22401   109.92831
   25    24 S   HC   HB21    33     1.09477   109.53324    53.92302
   26    24 S   HC   HB22    34     1.09506   110.84600   172.22065
   27    22 S   N    _N3_    24     1.38511   113.36156    41.62918
   28    27 S   H    _HN3    25     1.01526   118.90494    -0.65342
   29    24 S   S    _SG2    35     1.82912   111.73663   -68.75941
   30    27 S   CT   _CA3    26     1.45453   123.51314   175.14582
   31    30 S   HC   HA31    27     1.09518   109.31889    22.74539
   32    30 S   HC   HA32    28     1.09497   107.10056   139.76587
   33    29 S   CT   _C10    36     1.86451    99.82067   144.24123
   34    33 S   HC   _H3_    37     1.09244   103.20340    40.35164
   35    30 S   CO3  _C3_    29     1.52920   113.06294  -100.78638
   36    35 S   O2Z  _O31    30     1.26406   115.38895   -44.60954
   37    35 S   O2Z  _O32    31     1.26352   114.99260   136.31315
   38    33 S   CA   _C8_    38     1.53219   110.22551   -75.83565
   39    33 S   CT   _C11    49     1.58217   112.06677   155.21410
   40    38 S   CA   _C9_    39     1.41000   120.12503   -55.55220
   41    40 S   HA   _H7_    40     1.08795   120.73600     0.78285
   42    39 S   CA   _C15    50     1.54178   110.83805   -58.65078
   43    39 S   CT   _C12    61     1.55972   110.60655   179.65850
   44    43 S   HC   _H8_    62     1.09679   111.16414   -61.78347
   45    43 S   HC   _H9_    63     1.09630   111.40098    57.84923
   46    39 S   OH   _O33    71     1.43668   108.28030    61.23246
   47    46 S   HO   _H16    72     0.97221   108.95262    87.52597
   48    40 S   CA   _C4_    41     1.39613   121.56501  -179.60287
   49    48 S   HA   _H4_    42     1.08634   119.93459  -179.97202
   50    42 S   CA   _C16    51     1.40948   120.63404   -59.52258
   51    50 S   HA   _H12    52     1.08729   120.73804     0.12972
   52    43 S   NA   _N4_    64     1.45131   114.44769   179.34270
   53    48 S   CA   _C5_    43     1.38880   120.08060    -0.23985
   54    53 S   HA   _H5_    44     1.08620   120.05899  -179.66662
   55    50 S   CA   _C17    53     1.39579   121.11919  -179.60189
   56    55 S   HA   _H13    54     1.08545   120.32115  -179.95154
   57    52 S   CRA  _C13    65     1.36079   127.98458  -103.87438
   58    57 S   HA   _H10    66     1.08083   123.86278     1.71657
   59    53 S   CA   _C6_    45     1.39172   119.71905     0.39958
   60    59 S   HA   _H6_    46     1.08753   118.89272   179.72517
   61    55 S   CA   _C18    55     1.38822   119.49147     0.13122
   62    61 S   F    F1__    56     1.34005   119.56193   179.96574
   63    57 S   N5B  _N5_    67     1.31332   109.57789  -178.44304
   64    38 S   CA   _C7_    47     1.41038   122.55716   125.07962
   65    64 S   Cl   Cl1_    48     1.73114   122.51356     0.26319
   66    61 S   CA   _C19    57     1.38840   120.86313     0.06256
   67    66 S   HA   _H14    58     1.08551   120.18543   179.88986
   68    63 S   CRB  _C14    68     1.36555   102.56959     0.69492
   69    68 S   HA   _H11    69     1.08010   123.16426   179.91377
   70    42 S   CA   _C20    59     1.40762   121.45955   121.19537
   71    70 S   HA   _H15    60     1.08715   120.98110    -0.39416
   72    52 S   N5A  _N6_    70     1.34510   120.78912    79.27230
  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
  18   7   2   1   1  13  17   8   4  15  12   5   4   4   1   6
   3   8   4   6   5   3   6   3   5   3   3   2   5   3   3   1
   1   3   2   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    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    40    64    39    42    43    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    48    59    64    65    39    42    50    70    43    44    45    52    46    47  
   38    40    64    39    42    43    46  
   36    37  
   37  
    0  
   40    41    48    49    53    59    60    64    65    39    42    43    46  
   42    50    51    55    66    70    71    43    44    45    52    57    72    46    47    40    64  
   41    48    49    53    54    59    64    65  
   48    49    53    64  
   50    51    55    56    61    66    67    70    71    43    44    45    52    46    47  
   44    45    52    57    58    63    68    72    46    47    50    70  
   45    52    57    72    46  
   52    57    72    46  
   47    50    52    70  
    0  
   49    53    54    59    60    64  
   53    54    59  
   51    55    56    61    62    66    70    71  
   55    56    61    70  
   57    58    63    68    69    72  
   54    59    60    64    65  
   59    60    64  
   56    61    62    66    67    70  
   61    62    66  
   58    63    68    69    72  
   63    68    72  
   60    64    65  
   64    65  
   62    66    67    70    71  
   66    67    70  
   68    69    72  
   65  
    0  
   67    70    71  
   70    71  
   69    72  
   72  
   71  
    0  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.380000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.2500   0.1700   0.065600   1.8000   1.6000   0.001000000  -0.511443539
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700   0.277800   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.114600   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.220000   2.5000   1.7750   0.001000000  -0.843144165
   62   2.8500   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   63   3.2800   0.1700  -0.632900   1.8000   1.6000   0.001000000  -0.511443539
   64   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700   0.528100   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.052500   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.2800   0.1700  -0.528200   1.8000   1.6000   0.001000000  -0.511443539
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    39   268.000  1.529
   38    40   469.000  1.400
   38    64   469.000  1.400
   40    41   367.000  1.080
   40    48   469.000  1.400
   48    49   367.000  1.080
   48    53   469.000  1.400
   53    54   367.000  1.080
   53    59   469.000  1.400
   59    60   367.000  1.080
   59    64   469.000  1.400
   64    65   300.000  1.725
   39    42   317.000  1.510
   39    43   268.000  1.529
   39    46   320.000  1.410
   42    50   469.000  1.400
   42    70   469.000  1.400
   50    51   367.000  1.080
   50    55   469.000  1.400
   55    56   367.000  1.080
   55    61   469.000  1.400
   61    62   420.000  1.354
   61    66   469.000  1.400
   66    67   367.000  1.080
   66    70   469.000  1.400
   70    71   367.000  1.080
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    52   320.000  1.443
   52    57   477.000  1.343
   52    72   400.000  1.349
   57    58   367.000  1.080
   57    63   488.000  1.335
   63    68   470.000  1.361
   68    69   395.000  1.080
   68    72   550.000  1.323
   46    47   553.000  0.945
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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    40    70.00000  120.00000
   33    38    64    70.00000  120.00000
   33    39    42    70.00000  112.17500
   33    39    43    58.35000  112.70000
   33    39    46    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    48    63.00000  120.00000
   38    64    59    63.00000  120.00000
   38    64    65    75.00000  120.00000
   40    48    49    35.00000  120.00000
   40    48    53    63.00000  120.00000
   48    40    41    35.00000  120.00000
   48    53    54    35.00000  120.00000
   48    53    59    63.00000  120.00000
   53    48    49    35.00000  120.00000
   53    59    60    35.00000  120.00000
   53    59    64    63.00000  120.00000
   59    53    54    35.00000  120.00000
   59    64    65    75.00000  120.00000
   64    38    40    63.00000  120.00000
   64    59    60    35.00000  120.00000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    42    50    70.00000  120.00000
   39    42    70    70.00000  120.00000
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    52    75.00000  111.19500
   39    46    47    55.00000  108.50000
   42    50    51    35.00000  120.00000
   42    50    55    63.00000  120.00000
   42    70    66    63.00000  120.00000
   42    70    71    35.00000  120.00000
   50    55    56    35.00000  120.00000
   50    55    61    63.00000  120.00000
   55    50    51    35.00000  120.00000
   55    61    62    80.00000  120.00000
   55    61    66    63.00000  120.00000
   61    55    56    35.00000  120.00000
   61    66    67    35.00000  120.00000
   61    66    70    63.00000  120.00000
   66    61    62    80.00000  120.00000
   66    70    71    35.00000  120.00000
   70    42    50    63.00000  120.00000
   70    66    67    35.00000  120.00000
   43    39    42    70.00000  112.17500
   43    52    57    60.00000  127.66100
   43    52    72    75.00000  118.68000
   45    43    44    33.00000  107.80000
   52    43    44    50.00000  108.61900
   52    43    45    50.00000  108.61900
   52    57    58    35.00000  120.00000
   52    57    63    70.00000  120.00000
   52    72    68   115.00000  101.71600
   57    63    68   105.00000  102.26600
   63    57    58    35.00000  120.00000
   63    68    69    40.00000  123.47600
   63    68    72    85.00000  115.28900
   72    52    57    95.00000  110.06400
   72    68    69    45.00000  122.26300
   46    39    42    90.00000  112.51600
   46    39    43    50.00000  109.50000
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  -0.23050  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    40  -0.16000  1.0 1.0
   29    33    38    40  -0.03200 -1.0 2.0
   29    33    38    40   0.04500  1.0 3.0
   29    33    38    64  -0.16000  1.0 1.0
   29    33    38    64  -0.03200 -1.0 2.0
   29    33    38    64   0.04500  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   29    33    39    43   0.44750  1.0 1.0
   29    33    39    43  -0.17800 -1.0 2.0
   29    33    39    43   0.20200  1.0 3.0
   29    33    39    46   0.56750  1.0 1.0
   29    33    39    46  -0.07550 -1.0 2.0
   29    33    39    46   0.20000  1.0 3.0
   33    38    40    41   3.62500 -1.0 2.0
   33    38    40    48   3.62500 -1.0 2.0
   33    38    64    59   3.62500 -1.0 2.0
   33    38    64    65   3.62500 -1.0 2.0
   33    39    42    50   0.04150 -1.0 2.0
   33    39    42    70   0.04150 -1.0 2.0
   33    39    43    44   0.15000  1.0 3.0
   33    39    43    45   0.15000  1.0 3.0
   33    39    43    52  -0.64600  1.0 1.0
   33    39    43    52   0.58400 -1.0 2.0
   33    39    46    47  -0.11600  1.0 1.0
   33    39    46    47  -0.09450 -1.0 2.0
   33    39    46    47   0.21250  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    64   0.00000  1.0 1.0
   34    33    39    42   0.43200  1.0 3.0
   34    33    39    43   0.15000  1.0 3.0
   34    33    39    46   0.23400  1.0 3.0
   38    33    39    42  -0.94300  1.0 1.0
   38    33    39    42   1.32550 -1.0 2.0
   38    33    39    42  -0.07100  1.0 3.0
   38    33    39    43  -0.03700  1.0 1.0
   38    33    39    43   0.37200 -1.0 2.0
   38    33    39    43  -0.47300  1.0 3.0
   38    33    39    46   1.13150  1.0 1.0
   38    33    39    46  -1.01400 -1.0 2.0
   38    40    48    49   3.62500 -1.0 2.0
   38    40    48    53   3.62500 -1.0 2.0
   40    38    64    59   3.62500 -1.0 2.0
   40    38    64    65   3.62500 -1.0 2.0
   40    48    53    54   3.62500 -1.0 2.0
   40    48   -53    59   3.62500 -1.0 2.0
   41    40    48    49   3.62500 -1.0 2.0
   41    40    48    53   3.62500 -1.0 2.0
   48    53    59    60   3.62500 -1.0 2.0
   48    53    59    64   3.62500 -1.0 2.0
   49    48    53    54   3.62500 -1.0 2.0
   49    48    53    59   3.62500 -1.0 2.0
   53    59   -64    38   3.62500 -1.0 2.0
   53    59    64    65   3.62500 -1.0 2.0
   54    53    59    60   3.62500 -1.0 2.0
   54    53    59    64   3.62500 -1.0 2.0
   60    59    64    38   3.62500 -1.0 2.0
   60    59    64    65   3.62500 -1.0 2.0
   64    38    40    41   3.62500 -1.0 2.0
   64    38   -40    48   3.62500 -1.0 2.0
   39    33    38    40   0.04150 -1.0 2.0
   39    33    38    64   0.04150 -1.0 2.0
   39    42    50    51   3.62500 -1.0 2.0
   39    42    50    55   3.62500 -1.0 2.0
   39    42    70    66   3.62500 -1.0 2.0
   39    42    70    71   3.62500 -1.0 2.0
   39    43    52    57   1.10250  1.0 1.0
   39    43    52    57   0.01650 -1.0 2.0
   39    43    52    57   0.39100  1.0 3.0
   39    43    52    72   0.68100  1.0 1.0
   39    43    52    72   0.03350 -1.0 2.0
   39    43    52    72   0.36200  1.0 3.0
   42    39    43    44   0.43200  1.0 3.0
   42    39    43    45   0.43200  1.0 3.0
   42    39    43    52   0.56750  1.0 1.0
   42    39    43    52  -0.07550 -1.0 2.0
   42    39    43    52   0.20000  1.0 3.0
   42    39    46    47   0.31900  1.0 1.0
   42    39    46    47  -0.11800 -1.0 2.0
   42    39    46    47   0.38750  1.0 3.0
   42    50    55    56   3.62500 -1.0 2.0
   42    50    55    61   3.62500 -1.0 2.0
   50    42    70    66   3.62500 -1.0 2.0
   50    42    70    71   3.62500 -1.0 2.0
   50    55    61    62   3.62500 -1.0 2.0
   50    55   -61    66   3.62500 -1.0 2.0
   51    50    55    56   3.62500 -1.0 2.0
   51    50    55    61   3.62500 -1.0 2.0
   55    61    66    67   3.62500 -1.0 2.0
   55    61    66    70   3.62500 -1.0 2.0
   56    55    61    62   3.62500 -1.0 2.0
   56    55    61    66   3.62500 -1.0 2.0
   61    66   -70    42   3.62500 -1.0 2.0
   61    66    70    71   3.62500 -1.0 2.0
   62    61    66    67   3.62500 -1.0 2.0
   62    61    66    70   3.62500 -1.0 2.0
   67    66    70    42   3.62500 -1.0 2.0
   67    66    70    71   3.62500 -1.0 2.0
   70    42    50    51   3.62500 -1.0 2.0
   70    42   -50    55   3.62500 -1.0 2.0
   43    39    42    50   0.04150 -1.0 2.0
   43    39    42    70   0.04150 -1.0 2.0
   43    39    46    47  -0.11600  1.0 1.0
   43    39    46    47  -0.09450 -1.0 2.0
   43    39    46    47   0.21250  1.0 3.0
   43    52    57    58   3.62500 -1.0 2.0
   43    52    57    63   3.62500 -1.0 2.0
   43    52    72    68   3.62500 -1.0 2.0
   44    43    52    57   0.00000  1.0 1.0
   44    43    52    72   0.00000  1.0 1.0
   45    43    52    57   0.00000  1.0 1.0
   45    43    52    72   0.00000  1.0 1.0
   52    57   -63    68   3.62500 -1.0 2.0
   57    52   -72    68   3.62500 -1.0 2.0
   57    63    68    69   3.62500 -1.0 2.0
   57    63   -68    72   3.62500 -1.0 2.0
   58    57    63    68   3.62500 -1.0 2.0
   63    68   -72    52   3.62500 -1.0 2.0
   69    68    72    52   3.62500 -1.0 2.0
   72    52    57    58   3.62500 -1.0 2.0
   72    52   -57    63   3.62500 -1.0 2.0
   46    39    42    50   0.14300 -1.0 2.0
   46    39    42    50   0.00300  1.0 3.0
   46    39    42    70   0.14300 -1.0 2.0
   46    39    42    70   0.00300  1.0 3.0
   46    39    43    44   0.23400  1.0 3.0
   46    39    43    45   0.23400  1.0 3.0
   46    39    43    52  -0.86350  1.0 1.0
   46    39    43    52   0.04750 -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
   40    64    38    33   4.00000 -1.0 2.0
   48    41    40    38   1.10000 -1.0 2.0
   53    49    48    40   1.10000 -1.0 2.0
   59    54    53    48   1.10000 -1.0 2.0
   64    60    59    53   1.10000 -1.0 2.0
   59    65    64    38   4.00000 -1.0 2.0
   50    70    42    39   4.00000 -1.0 2.0
   55    51    50    42   1.10000 -1.0 2.0
   61    56    55    50   1.10000 -1.0 2.0
   66    62    61    55   4.00000 -1.0 2.0
   70    67    66    61   1.10000 -1.0 2.0
   66    71    70    42   1.10000 -1.0 2.0
   57    72    52    43   4.00000 -1.0 2.0
   63    58    57    52   1.10000 -1.0 2.0
   72    69    68    63   1.10000 -1.0 2.0
END
