* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    118    183     357
    1     0 S   NP   _N1_     1    29.51658    98.40288   -21.62691
    2     1 S   H    _HN1     2     1.02831    52.56439   157.00493
    3     1 S   H    _H1_     3     1.02813   103.09567  -100.42503
    4     1 S   H    _H2_     4     1.02949    58.83033     3.22561
    5     1 S   CT   _CA1     5     1.50091   144.68641    84.85843
    6     5 S   HC   _HA1     6     1.09579   105.19014   113.34303
    7     5 S   CO3  _C1_     7     1.53756   112.37969    -6.86944
    8     7 S   O2Z  _O11     8     1.26336   115.08761   -47.19042
    9     7 S   O2Z  _O12     9     1.26274   114.94111   131.90290
   10     5 S   CT   _CB1    10     1.53064   107.38665  -128.80296
   11    10 S   HC   HB11    11     1.09848   109.36069   -50.19641
   12    10 S   HC   HB12    12     1.09808   110.49214    66.37480
   13    10 S   CT   _CG1    13     1.53019   112.60372  -171.10821
   14    13 S   HC   HG11    14     1.09509   110.68674   -68.16853
   15    13 S   HC   HG12    15     1.09644   109.68133    51.11708
   16    13 S   C    _CD1    16     1.51747   111.68942   172.07908
   17    16 S   O    _OE1    17     1.22779   122.94126    20.90162
   18    16 S   N    _N2_    18     1.38577   112.10527  -159.50081
   19    18 S   H    _HN2    19     1.01655   119.27193     1.21047
   20    18 S   CT1  _CA2    20     1.46335   123.33060   176.29995
   21    20 S   HC   _HA2    21     1.09725   109.30519     9.87709
   22    20 S   C    _C2_    22     1.53763   109.11772  -105.77096
   23    22 S   O    _O2_    23     1.23086   122.17309  -151.99425
   24    20 S   CT   _CB2    32     1.53275   111.20118   131.92203
   25    24 S   HC   HB21    33     1.09437   109.18529    56.80746
   26    24 S   HC   HB22    34     1.09500   110.64275   175.14683
   27    22 S   N    _N3_    24     1.38290   114.01356    35.52392
   28    27 S   H    _HN3    25     1.01501   119.60089    -3.38136
   29    24 S   S    _SG2    35     1.83260   111.24872   -65.63647
   30    27 S   CT   _CA3    26     1.45266   123.42135   177.31467
   31    30 S   HC   HA31    27     1.09543   107.52572   -64.69735
   32    30 S   HC   HA32    28     1.09550   108.00876    51.79841
   33    29 S   CT   _C8_    36     1.84414   100.79162   147.07329
   34    30 S   CO3  _C3_    29     1.53007   113.94706   173.75471
   35    34 S   O2Z  _O31    30     1.26406   116.07667    -1.16231
   36    34 S   O2Z  _O32    31     1.26425   114.42912   178.89341
   37    33 S   CT   _C4_    37     1.53508   111.60903  -174.65493
   38    37 S   HC   _H8_    38     1.09828   112.26351   -45.24241
   39    37 S   HC   _H9_    39     1.09949   109.54747  -160.97338
   40    33 S   CO3  _C9_    64     1.55961   102.84793    68.53178
   41    40 S   O2Z  _O35    65     1.26668   115.95842    81.84264
   42    40 S   O2Z  _O34    66     1.26618   115.88412   -98.57087
   43    37 S   CT   _C5_    40     1.52662   112.26796    78.96278
   44    43 S   HC   _H3_    41     1.09658   109.58808   -70.70991
   45    43 S   CT   _C6_    42     1.53086   111.38910    49.82648
   46    45 S   HC   _H4_    43     1.09458   108.84544  -176.32582
   47    43 S   OH   _O40    62     1.42427   110.09903   171.84173
   48    47 S   HO   _H16    63     0.97241   107.54243    55.86392
   49    45 S   CT   _C7_    44     1.53197   109.56201   -54.11958
   50    49 S   HC   _H5_    45     1.09606   110.01789   -60.72086
   51    45 S   OH   _O39    60     1.42946   110.64217    66.88571
   52    51 S   HO   _H15    61     0.97293   107.85845   -70.75374
   53    33 S   OS   _O33    46     1.43577   113.63576   -48.60158
   54    49 S   CT   _C10    47     1.54079   114.63864   176.62757
   55    54 S   HC   _H6_    48     1.09721   109.97548   -74.64101
   56    54 S   CT   _C11    49     1.53590   115.54633    50.19426
   57    56 S   HC   _H7_    50     1.09499   110.69059   -62.41077
   58    54 S   OH   _O38    58     1.43846   107.08893   171.14703
   59    58 S   HO   _H14    59     0.97378   106.56524   178.92244
   60    56 S   CT   _C12    51     1.52697   113.81690    62.53017
   61    60 S   HC   _H10    52     1.09452   111.45914    66.17266
   62    60 S   HC   _H11    53     1.09288   111.47572   -56.76337
   63    56 S   OH   _O37    56     1.43489   107.45001  -177.72024
   64    63 S   HO   _H13    57     0.97396   106.66341  -176.49815
   65    60 S   OH   _O36    54     1.42531   108.72233  -175.46568
   66    65 S   HO   _H12    55     0.97713   106.40174   178.32836
  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  10   5   4   3
  14   2   1   1  14   7   6   5   2   1  11   6  12   7   3   1
  12   6   3   1   4  11   6  10   7   3   1   6   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    53    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    49    53    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    45    49    50    53    54    47    40    41    42  
   35    36  
   36  
    0  
   38    39    43    44    45    46    49    53    51    47    48    40    41    42  
   39    43    44    45    53    47    40  
   43    44    45    53    47    40  
   41    42    43    49    53  
   42    53  
   53  
   44    45    46    49    50    53    54    51    52    47    48  
   45    46    49    51    47    48  
   46    49    50    53    54    55    56    58    51    52    47    48  
   49    50    53    54    51    52    47  
   48    49    51  
    0  
   50    53    54    55    56    57    60    63    58    59    51    52  
   53    54    55    56    58    51  
   52    53    54  
    0  
   54    55    56    58  
   55    56    57    60    61    62    65    63    64    58    59  
   56    57    60    63    58    59  
   57    60    61    62    65    66    63    64    58    59  
   60    61    62    65    63    64    58  
   59    60    63  
    0  
   61    62    65    66    63    64  
   62    65    66    63  
   65    66    63  
   64    65  
    0  
   66  
    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  -0.316400   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   0.348900   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    53   320.000  1.410
   33    40   317.000  1.522
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   268.000  1.529
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    47   320.000  1.410
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   320.000  1.410
   49    50   340.000  1.090
   49    53   320.000  1.410
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    58   320.000  1.410
   56    57   340.000  1.090
   56    60   268.000  1.529
   56    63   320.000  1.410
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    65   320.000  1.410
   65    66   553.000  0.945
   63    64   553.000  0.945
   58    59   553.000  0.945
   51    52   553.000  0.945
   47    48   553.000  0.945
   40    41   656.000  1.250
   40    42   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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    37    75.00000  111.63000
   29    33    53    85.00000  114.68000
   29    33    40    70.00000  116.78000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    58.35000  112.70000
   33    53    49    60.00000  109.50000
   33    40    41    70.00000  117.00000
   33    40    42    70.00000  117.00000
   37    43    44    37.50000  110.70000
   37    43    45    58.35000  112.70000
   37    43    47    50.00000  109.50000
   39    37    38    33.00000  107.80000
   43    37    38    37.50000  110.70000
   43    37    39    37.50000  110.70000
   43    45    46    37.50000  110.70000
   43    45    49    58.35000  112.70000
   43    45    51    50.00000  109.50000
   43    47    48    55.00000  108.50000
   45    43    44    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    53    50.00000  109.50000
   45    49    54    58.35000  112.70000
   45    51    52    55.00000  108.50000
   49    45    46    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    56    58.35000  112.70000
   49    54    58    50.00000  109.50000
   53    33    37    50.00000  109.50000
   53    49    50    35.00000  109.50000
   54    49    50    37.50000  110.70000
   54    49    53    50.00000  109.50000
   54    56    57    37.50000  110.70000
   54    56    60    58.35000  112.70000
   54    56    63    50.00000  109.50000
   54    58    59    55.00000  108.50000
   56    54    55    37.50000  110.70000
   56    60    61    37.50000  110.70000
   56    60    62    37.50000  110.70000
   56    60    65    50.00000  109.50000
   56    63    64    55.00000  108.50000
   60    56    57    37.50000  110.70000
   60    65    66    55.00000  108.50000
   62    60    61    33.00000  107.80000
   65    60    61    35.00000  109.50000
   65    60    62    35.00000  109.50000
   63    56    57    35.00000  109.50000
   63    56    60    50.00000  109.50000
   58    54    55    35.00000  109.50000
   58    54    56    50.00000  109.50000
   51    45    46    35.00000  109.50000
   51    45    49    50.00000  109.50000
   47    43    44    35.00000  109.50000
   47    43    45    50.00000  109.50000
   40    33    37    70.00000  109.69300
   40    33    53    85.00000  109.63000
   42    40    41    80.00000  126.00000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    53   0.13850  1.0 1.0
   24    29    33    53  -1.34450 -1.0 2.0
   24    29    33    53   0.57400  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    53    49   0.14700  1.0 1.0
   29    33    53    49  -1.16150 -1.0 2.0
   29    33    53    49   0.48700  1.0 3.0
   29    33    40    41   0.30150 -1.0 2.0
   29    33    40    42   0.30150 -1.0 2.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.56750  1.0 1.0
   33    37    43    45  -0.07550 -1.0 2.0
   33    37    43    45   0.20000  1.0 3.0
   33    37    43    47   0.86500  1.0 1.0
   33    37    43    47  -0.17500 -1.0 2.0
   33    37    43    47   0.20800  1.0 3.0
   37    33    53    49   0.06250  1.0 1.0
   37    33    53    49  -0.01100 -1.0 2.0
   37    33    53    49   0.28050  1.0 3.0
   37    33    40    41   0.41150 -1.0 2.0
   37    33    40    42   0.41150 -1.0 2.0
   37    43    45    46   0.15000  1.0 3.0
   37    43   -45    49   0.56750  1.0 1.0
   37    43   -45    49  -0.07550 -1.0 2.0
   37    43   -45    49   0.20000  1.0 3.0
   37    43    45    51   0.86500  1.0 1.0
   37    43    45    51  -0.17500 -1.0 2.0
   37    43    45    51   0.20800  1.0 3.0
   37    43    47    48  -0.11600  1.0 1.0
   37    43    47    48  -0.09450 -1.0 2.0
   37    43    47    48   0.21250  1.0 3.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37    43    47   0.23400  1.0 3.0
   39    37    43    44   0.15000  1.0 3.0
   39    37    43    45   0.15000  1.0 3.0
   39    37    43    47   0.23400  1.0 3.0
   43    45    49    50   0.15000  1.0 3.0
   43    45    49    53   0.62750  1.0 1.0
   43    45    49    53  -0.30950 -1.0 2.0
   43    45    49    53   0.27300  1.0 3.0
   43    45    49    54   0.56750  1.0 1.0
   43    45    49    54  -0.07550 -1.0 2.0
   43    45    49    54   0.20000  1.0 3.0
   43    45    51    52  -0.11600  1.0 1.0
   43    45    51    52  -0.09450 -1.0 2.0
   43    45    51    52   0.21250  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    45    51   0.23400  1.0 3.0
   44    43    47    48   0.19450  1.0 3.0
   45    43    47    48  -0.11600  1.0 1.0
   45    43    47    48  -0.09450 -1.0 2.0
   45    43    47    48   0.21250  1.0 3.0
   45    49   -53    33   0.06250  1.0 1.0
   45    49   -53    33  -0.01100 -1.0 2.0
   45    49   -53    33   0.28050  1.0 3.0
   45    49    54    55   0.15000  1.0 3.0
   45    49    54    56   0.56750  1.0 1.0
   45    49    54    56  -0.07550 -1.0 2.0
   45    49    54    56   0.20000  1.0 3.0
   45    49    54    58   0.86500  1.0 1.0
   45    49    54    58  -0.17500 -1.0 2.0
   45    49    54    58   0.20800  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    53   0.23400  1.0 3.0
   46    45    49    54   0.15000  1.0 3.0
   46    45    51    52   0.19450  1.0 3.0
   49    45    51    52  -0.11600  1.0 1.0
   49    45    51    52  -0.09450 -1.0 2.0
   49    45    51    52   0.21250  1.0 3.0
   49    54    56    57   0.15000  1.0 3.0
   49    54    56    60   0.56750  1.0 1.0
   49    54    56    60  -0.07550 -1.0 2.0
   49    54    56    60   0.20000  1.0 3.0
   49    54    56    63   0.86500  1.0 1.0
   49    54    56    63  -0.17500 -1.0 2.0
   49    54    56    63   0.20800  1.0 3.0
   49    54    58    59  -0.11600  1.0 1.0
   49    54    58    59  -0.09450 -1.0 2.0
   49    54    58    59   0.21250  1.0 3.0
   50    49    53    33   0.37050  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    56   0.15000  1.0 3.0
   50    49    54    58   0.23400  1.0 3.0
   53    33    37    38   0.23400  1.0 3.0
   53    33    37    39   0.23400  1.0 3.0
   53    33   -37    43   0.62750  1.0 1.0
   53    33   -37    43  -0.30950 -1.0 2.0
   53    33   -37    43   0.27300  1.0 3.0
   53    33    40    41   0.30150 -1.0 2.0
   53    33    40    42   0.30150 -1.0 2.0
   53    49    54    55   0.23400  1.0 3.0
   53    49    54    56   0.62750  1.0 1.0
   53    49    54    56  -0.30950 -1.0 2.0
   53    49    54    56   0.27300  1.0 3.0
   53    49    54    58   3.69350  1.0 1.0
   53    49    54    58  -1.82950 -1.0 2.0
   54    49    53    33   0.06250  1.0 1.0
   54    49    53    33  -0.01100 -1.0 2.0
   54    49    53    33   0.28050  1.0 3.0
   54    56    60    61   0.15000  1.0 3.0
   54    56    60    62   0.15000  1.0 3.0
   54    56    60    65   0.86500  1.0 1.0
   54    56    60    65  -0.17500 -1.0 2.0
   54    56    60    65   0.20800  1.0 3.0
   54    56    63    64  -0.11600  1.0 1.0
   54    56    63    64  -0.09450 -1.0 2.0
   54    56    63    64   0.21250  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    60   0.15000  1.0 3.0
   55    54    56    63   0.23400  1.0 3.0
   55    54    58    59   0.19450  1.0 3.0
   56    54    58    59  -0.11600  1.0 1.0
   56    54    58    59  -0.09450 -1.0 2.0
   56    54    58    59   0.21250  1.0 3.0
   56    60    65    66  -0.11600  1.0 1.0
   56    60    65    66  -0.09450 -1.0 2.0
   56    60    65    66   0.21250  1.0 3.0
   57    56    60    61   0.15000  1.0 3.0
   57    56    60    62   0.15000  1.0 3.0
   57    56    60    65   0.23400  1.0 3.0
   57    56    63    64   0.19450  1.0 3.0
   60    56    63    64  -0.11600  1.0 1.0
   60    56    63    64  -0.09450 -1.0 2.0
   60    56    63    64   0.21250  1.0 3.0
   61    60    65    66   0.19450  1.0 3.0
   62    60    65    66   0.19450  1.0 3.0
   63    56    60    61   0.23400  1.0 3.0
   63    56    60    62   0.23400  1.0 3.0
   63    56    60    65   3.75450  1.0 1.0
   58    54    56    57   0.23400  1.0 3.0
   58    54    56    60   0.86500  1.0 1.0
   58    54    56    60  -0.17500 -1.0 2.0
   58    54    56    60   0.20800  1.0 3.0
   58    54    56    63   3.75450  1.0 1.0
   51    45    49    50   0.23400  1.0 3.0
   51    45    49    53   3.69350  1.0 1.0
   51    45    49    53  -1.82950 -1.0 2.0
   51    45    49    54   0.86500  1.0 1.0
   51    45    49    54  -0.17500 -1.0 2.0
   51    45    49    54   0.20800  1.0 3.0
   47    43    45    46   0.23400  1.0 3.0
   47    43    45    49   0.86500  1.0 1.0
   47    43    45    49  -0.17500 -1.0 2.0
   47    43    45    49   0.20800  1.0 3.0
   47    43    45    51   3.75450  1.0 1.0
   40    33    37    38  -0.11250  1.0 3.0
   40    33    37    39  -0.11250  1.0 3.0
   40    33    37    43  -1.63150  1.0 1.0
   40    33    37    43  -0.43550 -1.0 2.0
   40    33    37    43   0.24500  1.0 3.0
   40    33    53    49  -1.11000  1.0 1.0
   40    33    53    49   0.50250 -1.0 2.0
   40    33    53    49   0.47450  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   41    33    40    42  10.50000 -1.0 2.0
END
