* LIGAND DATABASE FILE (OPLS2005)
*
001      68    68    122    182     363
    1     0 S   NP   _N1_     1    28.74934    94.61968   -22.01419
    2     1 S   H    _HN1     2     1.02780    95.92690   -79.35682
    3     1 S   H    _H1_     3     1.02957    85.68944    28.67100
    4     1 S   H    _H2_     4     1.02841    29.94236   164.67218
    5     1 S   CT   _CA1     5     1.50111   139.57455   145.47352
    6     5 S   HC   _HA1     6     1.09572   105.23256    69.23349
    7     5 S   CO3  _C1_     7     1.53779   112.40147   -51.03432
    8     7 S   O2Z  _O11     8     1.26362   114.99189   -43.58655
    9     7 S   O2Z  _O12     9     1.26233   114.92242   135.61238
   10     5 S   CT   _CB1    10     1.53095   107.46677  -172.78757
   11    10 S   HC   HB11    11     1.09827   109.37859   -50.24895
   12    10 S   HC   HB12    12     1.09822   110.41689    66.32502
   13    10 S   CT   _CG1    13     1.53028   112.64835  -171.29918
   14    13 S   HC   HG11    14     1.09589   110.51021   -63.88947
   15    13 S   HC   HG12    15     1.09654   109.93973    55.36402
   16    13 S   C    _CD1    16     1.51791   112.26846   175.78750
   17    16 S   O    _OE1    17     1.22739   123.23119     1.07411
   18    16 S   N    _N2_    18     1.38659   111.69805  -179.05872
   19    18 S   H    _HN2    19     1.01594   119.10094     0.48979
   20    18 S   CT1  _CA2    20     1.46101   123.22607   179.90721
   21    20 S   HC   _HA2    21     1.09577   109.14459   -11.52848
   22    20 S   C    _C2_    22     1.53463   108.76070  -126.62696
   23    22 S   O    _O2_    23     1.23026   122.09537  -148.44813
   24    20 S   CT   _CB2    32     1.53407   111.80583   110.87377
   25    24 S   HC   HB21    33     1.09654   109.57002    61.21424
   26    24 S   HC   HB22    34     1.09566   111.00112   178.59946
   27    22 S   N    _N3_    24     1.38463   113.45181    39.14517
   28    27 S   H    _HN3    25     1.01522   118.89673    -1.05313
   29    24 S   S    _SG2    35     1.82787   114.52504   -58.52978
   30    27 S   CT   _CA3    26     1.45465   123.62819   174.64445
   31    30 S   HC   HA31    27     1.09509   109.41511    20.47215
   32    30 S   HC   HA32    28     1.09496   107.07426   137.56052
   33    29 S   CT   _C12    36     1.82840    99.83293   -69.94325
   34    33 S   HC   _H14    37     1.09338   107.33776   -58.11838
   35    33 S   HC   _H15    38     1.09364   109.22086    58.45003
   36    30 S   CO3  _C3_    29     1.52938   113.02094  -103.09210
   37    36 S   O2Z  _O31    30     1.26414   115.40878   -42.87068
   38    36 S   O2Z  _O32    31     1.26352   114.96776   138.00001
   39    33 S   CT   _C10    39     1.53928   113.30245   179.82754
   40    39 S   HC   _H8_    40     1.09756   108.85981   177.47757
   41    39 S   CT   _C11    41     1.53352   112.01331   -63.30759
   42    41 S   HC   _H11    42     1.09440   111.13589   -47.65557
   43    41 S   HC   _H12    43     1.09440   111.72558    75.22410
   44    39 S   OS1  _O34    46     1.43510   111.92997    57.40124
   45    41 S   OH   _O35    44     1.42585   109.09043  -166.33047
   46    45 S   HO   _H13    45     0.97235   106.96905  -178.97569
   47    44 S   CO1  _C9_    47     1.43203   114.84186    76.89839
   48    47 S   HC   _H7_    48     1.09426   108.94423   -52.22785
   49    47 S   CT   _C8_    49     1.53671   109.23206  -169.66382
   50    49 S   HC   _H6_    50     1.09668   109.95143   169.87074
   51    49 S   CT   _C7_    51     1.53001   110.67131   -69.52826
   52    51 S   HC   _H5_    52     1.09693   109.52144    70.32076
   53    49 S   OH5  _O36    67     1.42714   110.50963    51.91738
   54    53 S   HO   _H16    68     0.97218   107.77977    53.03291
   55    51 S   CT   _C6_    53     1.53423   110.93845   -51.36551
   56    55 S   HC   _H4_    54     1.09556   109.62940   173.75132
   57    51 S   OH5  _O37    65     1.42753   109.33728  -172.94893
   58    57 S   HO   _H17    66     0.97220   107.57796   176.37561
   59    55 S   CT   _C5_    55     1.53381   110.61511    51.57025
   60    59 S   HC   _H3_    56     1.09649   110.21853    64.08472
   61    55 S   OH5  _O38    63     1.43102   109.96698   -69.89481
   62    61 S   HO   _H18    64     0.97251   108.10115    71.11643
   63    47 S   OS1  _O33    57     1.43225   113.10905    67.48753
   64    59 S   CT   _C4_    58     1.52916   112.06266  -174.61853
   65    64 S   HC   _H9_    59     1.09478   111.47984    71.99733
   66    64 S   HC   _H10    60     1.09438   110.99732   -50.53704
   67    64 S   OH5  _O39    61     1.42500   109.06939  -169.34152
   68    67 S   HO   _H19    62     0.97229   107.03841  -179.29362
  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   7   5   4   3
  10   5   4   2   1   1  11   6   6   4   3   9   1   1  13   6
  12   7  13   7   4   1  12   7   3   1   9   6   3   1   4   4
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    44  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    45    44    47  
   35    39    40    41    44  
   39    40    41    44  
   37    38  
   38  
    0  
   40    41    42    43    45    46    44    47    48    49    63  
   41    42    43    45    44    47  
   42    43    45    46    44    47  
   43    45    46    44  
   45    46    44  
   47    48    49    50    51    59    63    53    45  
   46  
    0  
   48    49    50    51    52    55    59    60    63    64    57    53    54  
   49    50    51    59    63    53  
   50    51    52    55    56    59    63    61    57    58    53    54  
   51    52    55    63    57    53    54  
   52    55    56    59    60    63    64    61    62    57    58    53    54  
   55    56    59    61    57    58    53  
   54    55    57    63  
    0  
   56    59    60    63    64    65    66    67    61    62    57    58  
   59    60    63    64    61    62    57  
   58    59    61  
    0  
   60    63    64    65    66    67    68    61    62  
   63    64    65    66    67    61  
   62    63    64  
    0  
   64    65    66    67  
   65    66    67    68  
   66    67    68  
   67    68  
   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  -0.335000   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    44   335.000  1.422
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    45   320.000  1.410
   45    46   553.000  0.945
   44    47   370.000  1.399
   47    48   360.000  1.097
   47    49   255.000  1.525
   47    63   370.000  1.399
   49    50   340.000  1.090
   49    51   268.000  1.529
   49    53   355.000  1.421
   51    52   340.000  1.090
   51    55   268.000  1.529
   51    57   355.000  1.421
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    61   355.000  1.421
   59    60   340.000  1.090
   59    63   335.000  1.422
   59    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   355.000  1.421
   67    68   580.000  0.967
   61    62   580.000  0.967
   57    58   580.000  0.967
   53    54   580.000  0.967
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    44    95.00000  107.88500
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    37.50000  110.70000
   39    41    45    50.00000  109.50000
   39    44    47    90.00000  112.10700
   41    39    40    37.50000  110.70000
   41    45    46    55.00000  108.50000
   43    41    42    33.00000  107.80000
   45    41    42    35.00000  109.50000
   45    41    43    35.00000  109.50000
   44    39    40    55.00000  108.98800
   44    39    41    95.00000  107.88500
   44    47    48    60.00000  105.75400
   44    47    49    90.00000  109.70700
   44    47    63   110.00000  113.16000
   47    49    50    45.00000  109.54000
   47    49    51    70.00000  111.10000
   47    49    53    90.00000  109.42000
   47    63    59    90.00000  112.10700
   49    47    48    45.00000  111.65000
   49    51    52    37.50000  110.70000
   49    51    55    58.35000  112.70000
   49    51    57    90.00000  111.45300
   49    53    54    65.00000  108.53500
   51    49    50    37.50000  110.70000
   51    55    56    37.50000  110.70000
   51    55    59    58.35000  112.70000
   51    55    61    90.00000  111.45300
   51    57    58    65.00000  108.53500
   55    51    52    37.50000  110.70000
   55    59    60    37.50000  110.70000
   55    59    63    95.00000  107.88500
   55    59    64    58.35000  112.70000
   55    61    62    65.00000  108.53500
   59    55    56    37.50000  110.70000
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    67    90.00000  111.45300
   63    47    48    60.00000  105.75400
   63    47    49    90.00000  109.70700
   63    59    60    55.00000  108.98800
   64    59    60    37.50000  110.70000
   64    59    63    95.00000  107.88500
   64    67    68    65.00000  108.53500
   66    64    65    33.00000  107.80000
   67    64    65    60.00000  109.39000
   67    64    66    60.00000  109.39000
   61    55    56    60.00000  109.39000
   61    55    59    90.00000  111.45300
   57    51    52    60.00000  109.39000
   57    51    55    90.00000  111.45300
   53    49    50    60.00000  109.39000
   53    49    51    90.00000  111.45300
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.15000  1.0 3.0
   33    39    41    45   0.86500  1.0 1.0
   33    39    41    45  -0.17500 -1.0 2.0
   33    39    41    45   0.20800  1.0 3.0
   33    39    44    47   0.06250  1.0 1.0
   33    39    44    47  -0.01100 -1.0 2.0
   33    39    44    47   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    44   0.23400  1.0 3.0
   39    41    45    46  -0.11600  1.0 1.0
   39    41    45    46  -0.09450 -1.0 2.0
   39    41    45    46   0.21250  1.0 3.0
   39    44    47    48   0.37050  1.0 3.0
   39    44    47    49   0.06250  1.0 1.0
   39    44    47    49  -0.01100 -1.0 2.0
   39    44    47    49   0.28050  1.0 3.0
   39    44    47    63  -0.12700  1.0 1.0
   39    44    47    63  -1.16200 -1.0 2.0
   39    44    47    63   0.58800  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    44    47   0.37050  1.0 3.0
   41    39    44    47   0.06250  1.0 1.0
   41    39    44    47  -0.01100 -1.0 2.0
   41    39    44    47   0.28050  1.0 3.0
   42    41    45    46   0.19450  1.0 3.0
   43    41    45    46   0.19450  1.0 3.0
   44    39    41    42   0.23400  1.0 3.0
   44    39    41    43   0.23400  1.0 3.0
   44    39    41    45   3.69350  1.0 1.0
   44    39    41    45  -1.82950 -1.0 2.0
   44    47    49    50   0.23400  1.0 3.0
   44    47    49    51   0.62750  1.0 1.0
   44    47    49    51  -0.30950 -1.0 2.0
   44    47    49    51   0.27300  1.0 3.0
   44    47    49    53   1.51850  1.0 1.0
   44    47    63    59  -0.70400  1.0 1.0
   44    47    63    59  -0.90350 -1.0 2.0
   47    49    51    52   0.15000  1.0 3.0
   47    49    51    55   0.56750  1.0 1.0
   47    49    51    55  -0.07550 -1.0 2.0
   47    49    51    55   0.20000  1.0 3.0
   47    49    51    57  -0.47750  1.0 1.0
   47    49    53    54   0.29150  1.0 1.0
   47    49    53    54  -0.28350 -1.0 2.0
   47    49    53    54   0.43600  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    51   0.15000  1.0 3.0
   48    47    49    53   0.23400  1.0 3.0
   48    47    63    59   0.37050  1.0 3.0
   49    47    63    59   0.06250  1.0 1.0
   49    47    63    59  -0.01100 -1.0 2.0
   49    47    63    59   0.28050  1.0 3.0
   49    51    55    56   0.15000  1.0 3.0
   49    51   -55    59   0.56750  1.0 1.0
   49    51   -55    59  -0.07550 -1.0 2.0
   49    51   -55    59   0.20000  1.0 3.0
   49    51    55    61  -0.47750  1.0 1.0
   49    51    57    58   0.29150  1.0 1.0
   49    51    57    58  -0.28350 -1.0 2.0
   49    51    57    58   0.43600  1.0 3.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    55   0.15000  1.0 3.0
   50    49    51    57   0.23400  1.0 3.0
   50    49    53    54   0.19450  1.0 3.0
   51    49    53    54   0.29150  1.0 1.0
   51    49    53    54  -0.28350 -1.0 2.0
   51    49    53    54   0.43600  1.0 3.0
   51    55    59    60   0.15000  1.0 3.0
   51    55    59    63   0.62750  1.0 1.0
   51    55    59    63  -0.30950 -1.0 2.0
   51    55    59    63   0.27300  1.0 3.0
   51    55    59    64   0.56750  1.0 1.0
   51    55    59    64  -0.07550 -1.0 2.0
   51    55    59    64   0.20000  1.0 3.0
   51    55    61    62   0.29150  1.0 1.0
   51    55    61    62  -0.28350 -1.0 2.0
   51    55    61    62   0.43600  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    59   0.15000  1.0 3.0
   52    51    55    61   0.23400  1.0 3.0
   52    51    57    58   0.19450  1.0 3.0
   55    51    57    58   0.29150  1.0 1.0
   55    51    57    58  -0.28350 -1.0 2.0
   55    51    57    58   0.43600  1.0 3.0
   55    59   -63    47   0.06250  1.0 1.0
   55    59   -63    47  -0.01100 -1.0 2.0
   55    59   -63    47   0.28050  1.0 3.0
   55    59    64    65   0.15000  1.0 3.0
   55    59    64    66   0.15000  1.0 3.0
   55    59    64    67  -0.47750  1.0 1.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    63   0.23400  1.0 3.0
   56    55    59    64   0.15000  1.0 3.0
   56    55    61    62   0.19450  1.0 3.0
   59    55    61    62   0.29150  1.0 1.0
   59    55    61    62  -0.28350 -1.0 2.0
   59    55    61    62   0.43600  1.0 3.0
   59    64    67    68   0.29150  1.0 1.0
   59    64    67    68  -0.28350 -1.0 2.0
   59    64    67    68   0.43600  1.0 3.0
   60    59    63    47   0.37050  1.0 3.0
   60    59    64    65   0.15000  1.0 3.0
   60    59    64    66   0.15000  1.0 3.0
   60    59    64    67   0.23400  1.0 3.0
   63    47    49    50   0.23400  1.0 3.0
   63    47   -49    51   0.62750  1.0 1.0
   63    47   -49    51  -0.30950 -1.0 2.0
   63    47   -49    51   0.27300  1.0 3.0
   63    47    49    53   1.51850  1.0 1.0
   63    59    64    65   0.23400  1.0 3.0
   63    59    64    66   0.23400  1.0 3.0
   63    59    64    67   1.51850  1.0 1.0
   64    59    63    47   0.06250  1.0 1.0
   64    59    63    47  -0.01100 -1.0 2.0
   64    59    63    47   0.28050  1.0 3.0
   65    64    67    68   0.19450  1.0 3.0
   66    64    67    68   0.19450  1.0 3.0
   61    55    59    60   0.23400  1.0 3.0
   61    55    59    63   1.51850  1.0 1.0
   61    55    59    64  -0.47750  1.0 1.0
   57    51    55    56   0.23400  1.0 3.0
   57    51    55    59  -0.47750  1.0 1.0
   57    51    55    61   3.77950  1.0 1.0
   53    49    51    52   0.23400  1.0 3.0
   53    49    51    55  -0.47750  1.0 1.0
   53    49    51    57   3.77950  1.0 1.0
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
   37    30    36    38  10.50000 -1.0 2.0
END
