* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    134    211     395
    1     0 S   NP   _N1_     1    28.83506    95.07331   -22.31016
    2     1 S   H    _HN1     2     1.02780    97.68436   -94.78030
    3     1 S   H    _H1_     3     1.02951    81.85391    12.78936
    4     1 S   H    _H2_     4     1.02830    32.44994   153.77338
    5     1 S   CT   _CA1     5     1.50118   140.64863   125.17389
    6     5 S   HC   _HA1     6     1.09567   105.21349    75.16728
    7     5 S   CO3  _C1_     7     1.53801   112.45815   -45.10794
    8     7 S   O2Z  _O11     8     1.26374   114.98673   -41.12218
    9     7 S   O2Z  _O12     9     1.26237   114.98116   138.06280
   10     5 S   CT   _CB1    10     1.53089   107.43160  -166.75680
   11    10 S   HC   HB11    11     1.09827   109.46377   -48.90547
   12    10 S   HC   HB12    12     1.09818   110.38995    67.73925
   13    10 S   CT   _CG1    13     1.52973   112.60234  -169.88730
   14    13 S   HC   HG11    14     1.09596   110.53653   -64.01300
   15    13 S   HC   HG12    15     1.09659   109.89004    55.22623
   16    13 S   C    _CD1    16     1.51805   112.31341   175.73350
   17    16 S   O    _OE1    17     1.22717   123.31676     3.17583
   18    16 S   N    _N2_    18     1.38612   111.56016  -177.13529
   19    18 S   H    _HN2    19     1.01578   118.94577     2.51240
   20    18 S   CT1  _CA2    20     1.46312   123.52652  -179.13770
   21    20 S   HC   _HA2    21     1.09728   109.41457    -2.81125
   22    20 S   C    _C2_    22     1.53398   108.64161  -118.50934
   23    22 S   O    _O2_    23     1.23042   122.32923  -148.38000
   24    20 S   CT   _CB2    32     1.53335   111.06679   119.12152
   25    24 S   HC   HB21    33     1.09585   109.56988    56.52094
   26    24 S   HC   HB22    34     1.09493   110.98106   175.36139
   27    22 S   N    _N3_    24     1.38350   113.58043    39.10952
   28    27 S   H    _HN3    25     1.01620   119.50750    -3.55974
   29    24 S   S    _SG2    35     1.82599   111.07616   -64.88666
   30    27 S   CT   _CA3    26     1.45288   123.16340   176.99398
   31    30 S   HC   HA31    27     1.09551   107.51525   -64.13467
   32    30 S   HC   HA32    28     1.09558   107.96325    52.28057
   33    29 S   CT   _C18    36     1.81967    99.19628   150.48711
   34    33 S   HC   _H19    37     1.09525   110.27871   -46.80090
   35    33 S   HC   _H20    38     1.09489   108.33535    70.01819
   36    30 S   CO3  _C3_    29     1.52944   114.12346   174.26561
   37    36 S   O2Z  _O31    30     1.26370   116.06102    -0.97819
   38    36 S   O2Z  _O32    31     1.26430   114.41216   179.08850
   39    33 S   CM   _C16    39     1.50043   110.36084  -167.61767
   40    39 S   CMA  _C17    40     1.35040   126.93815   -96.35253
   41    40 S   OM   _O34    41     1.26303   128.08115     3.14939
   42    40 S   OS   _O33    42     1.41837   109.60060  -174.83593
   43    42 S   CT   _C10    43     1.44351   106.45365   -16.39654
   44    43 S   HC   _H5_    44     1.09985   106.68565   -91.19804
   45    43 S   CT   _C9_    45     1.53811   108.47376   149.78407
   46    45 S   HC   _H4_    46     1.10054   108.15705   -45.77917
   47    39 S   CT   _C11    62     1.50193   121.65809    91.24421
   48    47 S   HC   _H6_    63     1.09838   107.65096    74.93958
   49    45 S   CM   _C5_    47     1.51641   115.20422    72.79513
   50    49 S   CM   _C6_    48     1.33915   111.40288   143.37423
   51    50 S   HC   _H10    49     1.08083   124.76033   176.97541
   52    49 S   CT   _C4_    67     1.48827   123.15719   -40.38459
   53    52 S   HC   _H7_    68     1.09435   110.47038   -54.83201
   54    52 S   HC   _H8_    69     1.09521   111.52550  -174.43683
   55    52 S   HC   _H9_    70     1.09409   110.74916    65.84477
   56    50 S   CT   _C7_    50     1.49117   111.86650    -0.45671
   57    56 S   HC   _H11    51     1.09651   109.17260   101.49139
   58    56 S   HC   _H12    52     1.09326   112.32841  -139.14966
   59    45 S   CT   _C8_    53     1.55539   116.00575  -168.29142
   60    59 S   HC   _H3_    54     1.09906   109.05756    94.53140
   61    59 S   CM   _C14    55     1.52709   113.99965   -24.73283
   62    61 S   CT   _C13    56     1.51122   115.08821    84.22082
   63    62 S   HC   _H15    57     1.09730   109.48918    43.78062
   64    62 S   HC   _H16    58     1.09752   110.25485   159.01164
   65    61 S   CM   _C15    64     1.34383   125.18770   -97.14390
   66    65 S   HC   _H17    65     1.08339   122.57356     1.85794
   67    65 S   HC   _H18    66     1.08593   121.05959  -179.32449
   68    62 S   CT   _C12    59     1.52947   113.74211   -79.41068
   69    68 S   HC   _H13    60     1.09673   106.92442   177.89643
   70    68 S   HC   _H14    61     1.09810   109.26270   -67.38214
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  16   7  19   8  10   4
  12  11   5   5   2   1   1   7   4   3   9   3   9   8   5   4
   3   1   1   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    47  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    68    47    48  
   35    39    40    47  
   39    40    47  
   37    38  
   38  
    0  
   40    41    42    43    44    45    62    68    69    70    47    48  
   41    42    43    44    45    68    47    48  
   42    43    47  
   43    44    45    46    49    59    68    47    48  
   44    45    46    49    50    56    59    60    61    62    68    69    70    47    48    52  
   45    46    49    59    68    47    48  
   46    49    50    51    56    57    58    59    60    61    62    68    47    48    65    52    53    54    55  
   49    50    56    59    60    61    47    52  
   48    49    59    61    62    63    64    68    69    70  
   62    68    69    70  
   50    51    56    57    58    59    60    61    52    53    54    55  
   51    56    57    58    59    60    61    52    53    54    55  
   56    57    58    59    52  
   53    54    55    56    59  
   54    55  
   55  
    0  
   57    58    59    60    61    62    65  
   58    59    60    61  
   59    60    61  
   60    61    62    63    64    68    65    66    67  
   61    62    65  
   62    63    64    68    69    70    65    66    67  
   63    64    68    69    70    65    66    67  
   64    68    69    70    65  
   68    69    70    65  
   66    67    68  
   67  
    0  
   69    70  
   70  
    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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   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   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   39    40   465.000  1.376
   39    47   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    47   268.000  1.529
   45    46   340.000  1.090
   45    49   317.000  1.510
   45    59   268.000  1.529
   49    50   549.000  1.340
   49    52   317.000  1.510
   50    51   340.000  1.080
   50    56   317.000  1.510
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   268.000  1.529
   59    60   340.000  1.090
   59    61   317.000  1.510
   61    62   317.000  1.510
   61    65   549.000  1.340
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    47   268.000  1.529
   47    48   340.000  1.090
   65    66   340.000  1.080
   65    67   340.000  1.080
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  112.20000
   33    39    40    70.00000  124.00000
   33    39    47    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    47    43    70.00000  112.02700
   39    47    68    70.00000  112.02700
   39    47    48    35.00000  109.50000
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    47    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    49    70.00000  112.02700
   43    45    59    58.35000  112.70000
   43    47    68    58.35000  112.70000
   43    47    48    37.50000  110.70000
   45    43    44    37.50000  110.70000
   45    49    50    70.00000  124.00000
   45    49    52    65.00000  117.92700
   45    59    56    58.35000  112.70000
   45    59    60    37.50000  110.70000
   45    59    61    70.00000  112.02700
   49    45    46    35.00000  109.50000
   49    50    51    35.00000  120.00000
   49    50    56    70.00000  124.00000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    55    35.00000  109.50000
   50    56    57    35.00000  109.50000
   50    56    58    35.00000  109.50000
   50    56    59    70.00000  112.02700
   56    50    51    35.00000  117.00000
   56    59    60    37.50000  110.70000
   56    59    61    70.00000  112.02700
   58    56    57    33.00000  107.80000
   59    45    46    37.50000  110.70000
   59    45    49    70.00000  112.02700
   59    56    57    37.50000  110.70000
   59    56    58    37.50000  110.70000
   59    61    62    65.00000  117.92700
   59    61    65    70.00000  124.00000
   61    59    60    35.00000  109.50000
   61    62    63    35.00000  109.50000
   61    62    64    35.00000  109.50000
   61    62    68    70.00000  112.02700
   61    65    66    35.00000  120.00000
   61    65    67    35.00000  120.00000
   62    68    69    37.50000  110.70000
   62    68    70    37.50000  110.70000
   62    68    47    58.35000  112.70000
   64    62    63    33.00000  107.80000
   68    62    63    37.50000  110.70000
   68    62    64    37.50000  110.70000
   68    47    48    37.50000  110.70000
   70    68    69    33.00000  107.80000
   47    39    40    70.00000  124.00000
   47    43    44    37.50000  110.70000
   47    43    45    58.35000  112.70000
   47    68    69    37.50000  110.70000
   47    68    70    37.50000  110.70000
   65    61    62    70.00000  124.00000
   67    65    66    35.00000  117.00000
   52    49    50    70.00000  124.00000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    47   0.30250  1.0 1.0
   29    33    39    47  -0.14950 -1.0 2.0
   29    33    39    47   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    47    43   0.46850  1.0 1.0
   33    39    47    43   0.08550 -1.0 2.0
   33    39    47    43   0.09800  1.0 3.0
   33    39    47    68   0.46850  1.0 1.0
   33    39    47    68   0.08550 -1.0 2.0
   33    39    47    68   0.09800  1.0 3.0
   33    39    47    48   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    47   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    47   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   40    39   -47    43   0.09850  1.0 1.0
   40    39   -47    43   0.15250 -1.0 2.0
   40    39   -47    43  -0.50650  1.0 3.0
   40    39    47    68   0.09850  1.0 1.0
   40    39    47    68   0.15250 -1.0 2.0
   40    39    47    68  -0.50650  1.0 3.0
   40    39    47    48   0.00000  1.0 1.0
   40    42    43    44   0.08050  1.0 3.0
   40    42    43    45  -0.46850  1.0 1.0
   40    42    43    45   0.09300 -1.0 2.0
   40    42    43    45  -0.12850  1.0 3.0
   40    42   -43    47  -0.46850  1.0 1.0
   40    42   -43    47   0.09300 -1.0 2.0
   40    42   -43    47  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    49   0.61850  1.0 1.0
   42    43    45    49  -0.22750 -1.0 2.0
   42    43    45    49   0.15300  1.0 3.0
   42    43    45    59   0.62750  1.0 1.0
   42    43    45    59  -0.30950 -1.0 2.0
   42    43    45    59   0.27300  1.0 3.0
   42    43   -47    39   0.61850  1.0 1.0
   42    43   -47    39  -0.22750 -1.0 2.0
   42    43   -47    39   0.15300  1.0 3.0
   42    43    47    68   0.62750  1.0 1.0
   42    43    47    68  -0.30950 -1.0 2.0
   42    43    47    68   0.27300  1.0 3.0
   42    43    47    48   0.23400  1.0 3.0
   43    45    49    50   0.09850  1.0 1.0
   43    45    49    50   0.15250 -1.0 2.0
   43    45    49    50  -0.50650  1.0 3.0
   43    45    49    52   0.46850  1.0 1.0
   43    45    49    52   0.08550 -1.0 2.0
   43    45    49    52   0.09800  1.0 3.0
   43    45    59    56   0.56750  1.0 1.0
   43    45    59    56  -0.07550 -1.0 2.0
   43    45    59    56   0.20000  1.0 3.0
   43    45    59    60   0.15000  1.0 3.0
   43    45    59    61   0.34400  1.0 1.0
   43    45    59    61   0.09450 -1.0 2.0
   43    45    59    61   0.11100  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    59   0.15000  1.0 3.0
   44    43    47    39   0.15000  1.0 3.0
   44    43    47    68   0.15000  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   45    43    47    39   0.34400  1.0 1.0
   45    43    47    39   0.09450 -1.0 2.0
   45    43    47    39   0.11100  1.0 3.0
   45    43    47    68   0.56750  1.0 1.0
   45    43    47    68  -0.07550 -1.0 2.0
   45    43    47    68   0.20000  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    49    50    51   7.00000 -1.0 2.0
   45    49   -50    56   7.00000 -1.0 2.0
   45    49    52    53   0.34800  1.0 3.0
   45    49    52    54   0.34800  1.0 3.0
   45    49    52    55   0.34800  1.0 3.0
   45    59    61    62   0.46850  1.0 1.0
   45    59    61    62   0.08550 -1.0 2.0
   45    59    61    62   0.09800  1.0 3.0
   45    59    61    65   0.09850  1.0 1.0
   45    59    61    65   0.15250 -1.0 2.0
   45    59    61    65  -0.50650  1.0 3.0
   46    45    49    50   0.00000  1.0 1.0
   46    45    49    52   0.34800  1.0 3.0
   46    45    59    56   0.15000  1.0 3.0
   46    45    59    60   0.15000  1.0 3.0
   46    45    59    61   0.15000  1.0 3.0
   49    45   -59    56   0.34400  1.0 1.0
   49    45   -59    56   0.09450 -1.0 2.0
   49    45   -59    56   0.11100  1.0 3.0
   49    45    59    60   0.15000  1.0 3.0
   49    45    59    61   0.31000  1.0 1.0
   49    45    59    61   0.14700 -1.0 2.0
   49    45    59    61   0.07550  1.0 3.0
   49    50    56    57   0.00000  1.0 1.0
   49    50    56    58   0.00000  1.0 1.0
   49    50   -56    59   0.09850  1.0 1.0
   49    50   -56    59   0.15250 -1.0 2.0
   49    50   -56    59  -0.50650  1.0 3.0
   50    49    52    53   0.00000  1.0 1.0
   50    49    52    54   0.00000  1.0 1.0
   50    49    52    55   0.00000  1.0 1.0
   50    56   -59    45   0.34400  1.0 1.0
   50    56   -59    45   0.09450 -1.0 2.0
   50    56   -59    45   0.11100  1.0 3.0
   50    56    59    60   0.15000  1.0 3.0
   50    56    59    61   0.31000  1.0 1.0
   50    56    59    61   0.14700 -1.0 2.0
   50    56    59    61   0.07550  1.0 3.0
   51    50    56    57   0.33100  1.0 3.0
   51    50    56    58   0.33100  1.0 3.0
   51    50    56    59   0.00000  1.0 1.0
   56    59    61    62   0.46850  1.0 1.0
   56    59    61    62   0.08550 -1.0 2.0
   56    59    61    62   0.09800  1.0 3.0
   56    59    61    65   0.09850  1.0 1.0
   56    59    61    65   0.15250 -1.0 2.0
   56    59    61    65  -0.50650  1.0 3.0
   57    56    59    45   0.15000  1.0 3.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   58    56    59    45   0.15000  1.0 3.0
   58    56    59    60   0.15000  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   59    45   -49    50   0.09850  1.0 1.0
   59    45   -49    50   0.15250 -1.0 2.0
   59    45   -49    50  -0.50650  1.0 3.0
   59    45    49    52   0.46850  1.0 1.0
   59    45    49    52   0.08550 -1.0 2.0
   59    45    49    52   0.09800  1.0 3.0
   59    61    62    63   0.34800  1.0 3.0
   59    61    62    64   0.34800  1.0 3.0
   59    61    62    68   0.46850  1.0 1.0
   59    61    62    68   0.08550 -1.0 2.0
   59    61    62    68   0.09800  1.0 3.0
   59    61    65    66   7.00000 -1.0 2.0
   59    61    65    67   7.00000 -1.0 2.0
   60    59    61    62   0.34800  1.0 3.0
   60    59    61    65   0.00000  1.0 1.0
   61    62    68    69   0.15000  1.0 3.0
   61    62    68    70   0.15000  1.0 3.0
   61    62    68    47   0.34400  1.0 1.0
   61    62    68    47   0.09450 -1.0 2.0
   61    62    68    47   0.11100  1.0 3.0
   62    61    65    66   7.00000 -1.0 2.0
   62    61    65    67   7.00000 -1.0 2.0
   62    68    47    39   0.34400  1.0 1.0
   62    68    47    39   0.09450 -1.0 2.0
   62    68    47    39   0.11100  1.0 3.0
   62    68    47    43   0.56750  1.0 1.0
   62    68    47    43  -0.07550 -1.0 2.0
   62    68    47    43   0.20000  1.0 3.0
   62    68    47    48   0.15000  1.0 3.0
   63    62    68    69   0.15000  1.0 3.0
   63    62    68    70   0.15000  1.0 3.0
   63    62    68    47   0.15000  1.0 3.0
   64    62    68    69   0.15000  1.0 3.0
   64    62    68    70   0.15000  1.0 3.0
   64    62    68    47   0.15000  1.0 3.0
   69    68    47    39   0.15000  1.0 3.0
   69    68    47    43   0.15000  1.0 3.0
   69    68    47    48   0.15000  1.0 3.0
   70    68    47    39   0.15000  1.0 3.0
   70    68    47    43   0.15000  1.0 3.0
   70    68    47    48   0.15000  1.0 3.0
   47    39    40    41   7.00000 -1.0 2.0
   47    39   -40    42   7.00000 -1.0 2.0
   47    43    45    46   0.15000  1.0 3.0
   47    43    45    49   0.34400  1.0 1.0
   47    43    45    49   0.09450 -1.0 2.0
   47    43    45    49   0.11100  1.0 3.0
   47    43    45    59   0.56750  1.0 1.0
   47    43    45    59  -0.07550 -1.0 2.0
   47    43    45    59   0.20000  1.0 3.0
   65    61    62    63   0.00000  1.0 1.0
   65    61    62    64   0.00000  1.0 1.0
   65    61    62    68   0.09850  1.0 1.0
   65    61    62    68   0.15250 -1.0 2.0
   65    61    62    68  -0.50650  1.0 3.0
   52    49    50    51   7.00000 -1.0 2.0
   52    49    50    56   7.00000 -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
   37    30    36    38  10.50000 -1.0 2.0
   33    47    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   45    52    49    50   1.10000 -1.0 2.0
   56    51    50    49   1.10000 -1.0 2.0
   59    62    61    65   1.10000 -1.0 2.0
   66    67    65    61   1.10000 -1.0 2.0
END
