* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    118    192     347
    1     0 S   NP   _N1_     1    29.34221    99.22051   -21.14065
    2     1 S   H    _HN1     2     1.02945    52.95346     5.29794
    3     1 S   H    _H1_     3     1.02826    60.03363   154.56748
    4     1 S   H    _H2_     4     1.02797    99.83841  -100.36668
    5     1 S   CT   _CA1     5     1.50095   147.77694    73.08750
    6     5 S   HC   _HA1     6     1.09580   105.15731   125.54963
    7     5 S   CO3  _C1_     7     1.53768   112.65966     5.40370
    8     7 S   O2Z  _O11     8     1.26372   114.99490   -40.30526
    9     7 S   O2Z  _O12     9     1.26257   114.94480   138.85271
   10     5 S   CT   _CB1    10     1.53074   107.42110  -116.51388
   11    10 S   HC   HB11    11     1.09837   109.30276   -50.55138
   12    10 S   HC   HB12    12     1.09808   110.49168    66.08013
   13    10 S   CT   _CG1    13     1.52951   112.52777  -171.53515
   14    13 S   HC   HG11    14     1.09538   110.56577   -69.77302
   15    13 S   HC   HG12    15     1.09663   109.67646    49.45980
   16    13 S   C    _CD1    16     1.51703   112.08058   170.37782
   17    16 S   O    _OE1    17     1.22750   123.10061    18.30696
   18    16 S   N    _N2_    18     1.38592   111.80942  -161.95663
   19    18 S   H    _HN2    19     1.01587   119.11003     1.20982
   20    18 S   CT1  _CA2    20     1.46277   123.53523   177.20264
   21    20 S   HC   _HA2    21     1.09730   109.21080    11.64552
   22    20 S   C    _C2_    22     1.53810   109.53364  -104.14133
   23    22 S   O    _O2_    23     1.23113   122.08737  -154.05833
   24    20 S   CT   _CB2    32     1.53373   111.04017   133.64275
   25    24 S   HC   HB21    33     1.09374   109.07038    57.08210
   26    24 S   HC   HB22    34     1.09391   110.29821   175.25360
   27    22 S   N    _N3_    24     1.38255   114.17008    33.35368
   28    27 S   H    _HN3    25     1.01495   119.59050    -3.50459
   29    24 S   S    _SG2    35     1.83260   110.97640   -65.81392
   30    27 S   CT   _CA3    26     1.45266   123.41681   177.29087
   31    30 S   HC   HA31    27     1.09545   107.52938   -64.71704
   32    30 S   HC   HA32    28     1.09553   108.00612    51.77701
   33    29 S   CT   _C12    36     1.83590   102.21701   148.95235
   34    33 S   OM   _O36    37     1.31816   110.12420   179.32160
   35    30 S   CO3  _C3_    29     1.53008   113.95373   173.74458
   36    35 S   O2Z  _O31    30     1.26406   116.06168    -0.70360
   37    35 S   O2Z  _O32    31     1.26424   114.41771   179.36944
   38    33 S   CM   _C13    38     1.51965   112.65917    54.10292
   39    38 S   CA   _C15    39     1.48087   123.86341    58.23897
   40    38 S   CMA  _C14    51     1.36124   111.04289  -120.34530
   41    40 S   OM   _O34    52     1.26500   129.31292  -179.64064
   42    39 S   CA   _C16    40     1.40488   120.05174  -116.68230
   43    42 S   HA   _H8_    41     1.08774   120.41214    -0.10087
   44    40 S   OS   _O33    53     1.42968   108.30438     0.46478
   45    42 S   CA   _C17    42     1.39637   120.85995   179.68721
   46    45 S   HA   _H9_    43     1.08594   119.80772  -179.79252
   47    33 S   CM   _C11    54     1.51335   111.87003   -59.53836
   48    45 S   CA   _C18    44     1.39017   119.57492     0.27268
   49    47 S   CM   _C10    55     1.34680   128.47567   -57.19026
   50    49 S   HC   _H7_    56     1.08815   118.59832     0.06561
   51    48 S   CA   _C19    45     1.39175   120.64248     0.16551
   52    51 S   HA   _H10    46     1.08586   121.04359   179.58269
   53    48 S   OH   _O35    49     1.36623   118.28346   180.00000
   54    53 S   HO   _H12    50     0.97230   108.41650  -179.87333
   55    49 S   CA   _C9_    57     1.47094   126.44378   178.74914
   56    39 S   CA   _C20    47     1.40235   121.43585    63.66922
   57    56 S   HA   _H11    48     1.08680   120.76432     1.12344
   58    55 S   CA   _C4_    58     1.40311   118.57390  -143.52780
   59    58 S   HA   _H3_    59     1.08708   120.59220     1.46767
   60    58 S   CA   _C5_    60     1.39633   120.79689  -178.60521
   61    60 S   HA   _H4_    61     1.08636   119.76173  -179.67736
   62    60 S   CA   _C6_    62     1.39041   119.57469     0.63366
   63    62 S   CA   _C7_    63     1.39201   120.64414     0.40926
   64    63 S   HA   _H5_    64     1.08598   121.02153   179.27476
   65    62 S   OH   _O37    67     1.36605   118.27610  -179.95154
   66    65 S   HO   _H13    68     0.97232   108.50121  -179.92087
   67    55 S   CA   _C8_    65     1.40247   122.68606    39.71055
   68    67 S   HA   _H6_    66     1.08745   120.86450    -0.85980
  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
  12   6   2   1   1  12  13   6   2   8   4   4   7   3   5   6
   8   3   5   3   2   1   9   1   1   8   4   7   3   6   5   3
   2   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    47    49  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    56    40    41    44    47    49    50    55  
   38    39    40    44    47    49  
   36    37  
   37  
    0  
   39    42    43    45    51    56    57    40    41    44    47    49  
   42    43    45    46    48    51    52    56    57    40    41    44    47  
   41    44    47    49    42    56  
   44    47  
   43    45    46    48    51    56    57    53  
   45    46    48    56  
   47    49    50    55  
   46    48    51    52    56    53    54  
   48    51    53  
   49    50    55    58    67  
   51    52    56    57    53    54  
   50    55    58    59    60    63    67    68  
   55    58    67  
   52    56    57    53    54  
   56    57    53  
   54    56  
    0  
   58    59    60    61    62    63    64    67    68  
   57  
    0  
   59    60    61    62    63    67    68    65  
   60    61    62    67  
   61    62    63    64    67    65    66  
   62    63    65  
   63    64    67    68    65    66  
   64    67    68    65    66  
   67    68    65  
   66    67  
    0  
   68  
    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  -0.012500   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   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   2.8500   0.1400  -0.570000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    47   317.000  1.510
   38    39   320.000  1.460
   38    40   465.000  1.376
   39    42   469.000  1.400
   39    56   469.000  1.400
   42    43   367.000  1.080
   42    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    53   450.000  1.364
   51    52   367.000  1.080
   51    56   469.000  1.400
   56    57   367.000  1.080
   53    54   553.000  0.945
   40    41   745.000  1.250
   40    44   440.000  1.360
   44    47   440.000  1.360
   47    49   549.000  1.340
   49    50   340.000  1.080
   49    55   320.000  1.460
   55    58   469.000  1.400
   55    67   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   469.000  1.400
   62    65   450.000  1.364
   63    64   367.000  1.080
   63    67   469.000  1.400
   67    68   367.000  1.080
   65    66   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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    47    75.00000  112.20000
   33    38    39    60.00000  124.00000
   33    38    40    70.00000  124.00000
   33    47    44    85.00000  112.85300
   33    47    49    70.00000  124.00000
   38    33    34    85.00000  110.90400
   38    39    42    60.00000  118.70000
   38    39    56    60.00000  118.70000
   38    40    41    65.00000  137.10300
   38    40    44    80.00000  120.01400
   39    42    43    35.00000  120.00000
   39    42    45    63.00000  120.00000
   39    56    51    63.00000  120.00000
   39    56    57    35.00000  120.00000
   42    45    46    35.00000  120.00000
   42    45    48    63.00000  120.00000
   45    42    43    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    53    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    56    63.00000  120.00000
   48    53    54    35.00000  113.00000
   51    56    57    35.00000  120.00000
   56    39    42    63.00000  120.00000
   56    51    52    35.00000  120.00000
   53    48    51    70.00000  120.00000
   40    38    39    60.00000  123.66000
   40    44    47    90.00000  114.05000
   44    40    41    65.00000  121.00000
   44    47    49    80.00000  120.01400
   47    33    34    85.00000  110.90400
   47    33    38    70.00000  110.12100
   47    49    50    35.00000  120.00000
   47    49    55    60.00000  123.20500
   49    55    58    60.00000  120.93500
   49    55    67    60.00000  120.93500
   55    49    50    40.00000  117.26300
   55    58    59    35.00000  120.00000
   55    58    60    63.00000  120.00000
   55    67    63    63.00000  120.00000
   55    67    68    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    62    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    62    63    63.00000  120.00000
   60    62    65    70.00000  120.00000
   62    60    61    35.00000  120.00000
   62    63    64    35.00000  120.00000
   62    63    67    63.00000  120.00000
   62    65    66    35.00000  113.00000
   63    67    68    35.00000  120.00000
   67    55    58    63.00000  120.00000
   67    63    64    35.00000  120.00000
   65    62    63    70.00000  120.00000
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  -0.62250  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    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   0.81900  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   0.09700  1.0 1.0
   29    33    38    39   0.15600 -1.0 2.0
   29    33    38    39  -0.50800  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    47    44   0.09700  1.0 1.0
   29    33    47    44   0.15600 -1.0 2.0
   29    33    47    44  -0.50800  1.0 3.0
   29    33    47    49   0.42700  1.0 1.0
   29    33    47    49  -0.70350 -1.0 2.0
   29    33    47    49  -0.43150  1.0 3.0
   33    38    39    42  -0.02500  1.0 1.0
   33    38    39    42  -0.32150 -1.0 2.0
   33    38    39    42  -0.01500  1.0 3.0
   33    38    39    56  -0.02500  1.0 1.0
   33    38    39    56  -0.32150 -1.0 2.0
   33    38    39    56  -0.01500  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38   -40    44   7.00000 -1.0 2.0
   33    47    49    50   7.00000 -1.0 2.0
   33    47    49    55   7.00000 -1.0 2.0
   34    33    38    39   0.09700  1.0 1.0
   34    33    38    39   0.15600 -1.0 2.0
   34    33    38    39  -0.50800  1.0 3.0
   34    33    38    40   0.39000  1.0 1.0
   34    33    38    40  -0.05800 -1.0 2.0
   34    33    38    40  -0.55150  1.0 3.0
   34    33    47    44   0.09700  1.0 1.0
   34    33    47    44   0.15600 -1.0 2.0
   34    33    47    44  -0.50800  1.0 3.0
   34    33    47    49   0.39000  1.0 1.0
   34    33    47    49  -0.05800 -1.0 2.0
   34    33    47    49  -0.55150  1.0 3.0
   38    33   -47    44   0.09700  1.0 1.0
   38    33   -47    44   0.15600 -1.0 2.0
   38    33   -47    44  -0.50800  1.0 3.0
   38    33    47    49  -0.28300  1.0 1.0
   38    33    47    49   0.26700 -1.0 2.0
   38    33    47    49  -0.63300  1.0 3.0
   38    39    42    43   3.62500 -1.0 2.0
   38    39    42    45   3.62500 -1.0 2.0
   38    39    56    51   3.62500 -1.0 2.0
   38    39    56    57   3.62500 -1.0 2.0
   38    40   -44    47   2.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    44   7.00000 -1.0 2.0
   39    42    45    46   3.62500 -1.0 2.0
   39    42    45    48   3.62500 -1.0 2.0
   42    39    56    51   3.62500 -1.0 2.0
   42    39    56    57   3.62500 -1.0 2.0
   42    45   -48    51   3.62500 -1.0 2.0
   42    45    48    53   3.62500 -1.0 2.0
   43    42    45    46   3.62500 -1.0 2.0
   43    42    45    48   3.62500 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    56   3.62500 -1.0 2.0
   45    48    53    54   0.84100 -1.0 2.0
   46    45    48    51   3.62500 -1.0 2.0
   46    45    48    53   3.62500 -1.0 2.0
   48    51   -56    39   3.62500 -1.0 2.0
   48    51    56    57   3.62500 -1.0 2.0
   51    48    53    54   0.84100 -1.0 2.0
   52    51    56    39   3.62500 -1.0 2.0
   52    51    56    57   3.62500 -1.0 2.0
   56    39    42    43   3.62500 -1.0 2.0
   56    39   -42    45   3.62500 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    56   3.62500 -1.0 2.0
   40    38    39    42   0.15800  1.0 1.0
   40    38    39    42   1.85350 -1.0 2.0
   40    38    39    42  -0.48700  1.0 3.0
   40    38    39    56   0.15800  1.0 1.0
   40    38    39    56   1.85350 -1.0 2.0
   40    38    39    56  -0.48700  1.0 3.0
   40    44   -47    33   2.00000 -1.0 2.0
   40    44    47    49   2.00000 -1.0 2.0
   41    40    44    47   2.00000 -1.0 2.0
   44    47    49    50   7.00000 -1.0 2.0
   44    47    49    55   7.00000 -1.0 2.0
   47    33    38    39   0.09700  1.0 1.0
   47    33    38    39   0.15600 -1.0 2.0
   47    33    38    39  -0.50800  1.0 3.0
   47    33   -38    40  -0.28300  1.0 1.0
   47    33   -38    40   0.26700 -1.0 2.0
   47    33   -38    40  -0.63300  1.0 3.0
   47    49    55    58   0.15800  1.0 1.0
   47    49    55    58   1.85350 -1.0 2.0
   47    49    55    58  -0.48700  1.0 3.0
   47    49    55    67   0.15800  1.0 1.0
   47    49    55    67   1.85350 -1.0 2.0
   47    49    55    67  -0.48700  1.0 3.0
   49    55    58    59   3.62500 -1.0 2.0
   49    55    58    60   3.62500 -1.0 2.0
   49    55    67    63   3.62500 -1.0 2.0
   49    55    67    68   3.62500 -1.0 2.0
   50    49    55    58   0.56550  1.0 3.0
   50    49    55    67   0.56550  1.0 3.0
   55    58    60    61   3.62500 -1.0 2.0
   55    58    60    62   3.62500 -1.0 2.0
   58    55    67    63   3.62500 -1.0 2.0
   58    55    67    68   3.62500 -1.0 2.0
   58    60   -62    63   3.62500 -1.0 2.0
   58    60    62    65   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   60    62    63    64   3.62500 -1.0 2.0
   60    62    63    67   3.62500 -1.0 2.0
   60    62    65    66   0.84100 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    65   3.62500 -1.0 2.0
   62    63   -67    55   3.62500 -1.0 2.0
   62    63    67    68   3.62500 -1.0 2.0
   63    62    65    66   0.84100 -1.0 2.0
   64    63    67    55   3.62500 -1.0 2.0
   64    63    67    68   3.62500 -1.0 2.0
   67    55    58    59   3.62500 -1.0 2.0
   67    55   -58    60   3.62500 -1.0 2.0
   65    62    63    64   3.62500 -1.0 2.0
   65    62    63    67   3.62500 -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    39    38    40   1.10000 -1.0 2.0
   42    56    39    38   4.00000 -1.0 2.0
   45    43    42    39   1.10000 -1.0 2.0
   48    46    45    42   1.10000 -1.0 2.0
   51    53    48    45   4.00000 -1.0 2.0
   56    52    51    48   1.10000 -1.0 2.0
   51    57    56    39   1.10000 -1.0 2.0
   41    44    40    38   1.10000 -1.0 2.0
   33    44    47    49   1.10000 -1.0 2.0
   55    50    49    47   1.10000 -1.0 2.0
   58    67    55    49   4.00000 -1.0 2.0
   60    59    58    55   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   63    65    62    60   4.00000 -1.0 2.0
   67    64    63    62   1.10000 -1.0 2.0
   63    68    67    55   1.10000 -1.0 2.0
END
