* LIGAND DATABASE FILE (OPLS2005)
*
001      69    70    122    189     357
    1     0 S   NP   _N1_     1    28.88453    95.90246   -22.13604
    2     1 S   H    _HN1     2     1.02831    36.59027   161.71004
    3     1 S   H    _H1_     3     1.02783    96.93749   -87.50930
    4     1 S   H    _H2_     4     1.02952    78.13106    19.84133
    5     1 S   CT   _CA1     5     1.50101   143.80772   128.31068
    6     5 S   HC   _HA1     6     1.09576   105.21430    79.75819
    7     5 S   CO3  _C1_     7     1.53765   112.41493   -40.43923
    8     7 S   O2Z  _O11     8     1.26363   115.04544   -44.04324
    9     7 S   O2Z  _O12     9     1.26241   114.93264   135.17263
   10     5 S   CT   _CB1    10     1.53092   107.42824  -162.34134
   11    10 S   HC   HB11    11     1.09826   109.31805   -50.63747
   12    10 S   HC   HB12    12     1.09815   110.45708    65.94049
   13    10 S   CT   _CG1    13     1.52980   112.62923  -171.70393
   14    13 S   HC   HG11    14     1.09597   110.48235   -64.88142
   15    13 S   HC   HG12    15     1.09664   109.92521    54.32713
   16    13 S   C    _CD1    16     1.51820   112.34850   174.68253
   17    16 S   O    _OE1    17     1.22716   123.33472     0.72847
   18    16 S   N    _N2_    18     1.38605   111.56443  -179.22747
   19    18 S   H    _HN2    19     1.01598   118.93539     1.39058
   20    18 S   CT1  _CA2    20     1.46258   123.51398   178.98741
   21    20 S   HC   _HA2    21     1.09731   109.43877    -5.94702
   22    20 S   C    _C2_    22     1.53425   108.42877  -121.47201
   23    22 S   O    _O2_    23     1.23035   122.35885  -148.16939
   24    20 S   CT   _CB2    32     1.53310   111.22799   116.21685
   25    24 S   HC   HB21    33     1.09455   109.56944    54.31460
   26    24 S   HC   HB22    34     1.09500   110.74016   173.25157
   27    22 S   N    _N3_    24     1.38360   113.52743    39.36065
   28    27 S   H    _HN3    25     1.01629   119.51060    -3.60098
   29    24 S   S    _SG2    35     1.82757   111.29606   -67.28407
   30    27 S   CT   _CA3    26     1.45286   123.14316   176.98046
   31    30 S   HC   HA31    27     1.09551   107.53110   -63.78416
   32    30 S   HC   HA32    28     1.09558   107.94442    52.62701
   33    29 S   CT   _C17    36     1.83763    99.75342   166.45404
   34    33 S   HC   _H3_    37     1.09497   108.15236    39.65494
   35    30 S   CO3  _C3_    29     1.52937   114.12723   174.60897
   36    35 S   O2Z  _O31    30     1.26368   116.06147    -0.67319
   37    35 S   O2Z  _O32    31     1.26430   114.41196   179.38008
   38    33 S   CO4  _C13    38     1.51745   108.12673   -78.17730
   39    38 S   O    _O18    39     1.23108   120.70540    96.11989
   40    38 S   CM   _C11    40     1.50587   118.67438   -81.35097
   41    40 S   CM   _C10    41     1.34340   118.64725   -13.00906
   42    41 S   HC   _H26    42     1.08465   122.04010   177.55103
   43    40 S   CT   _C19    52     1.52814   116.07696   164.54317
   44    43 S   HC   _H35    53     1.10073   105.85428   -36.10109
   45    41 S   CO4  _C12    43     1.48477   122.88527    -4.29085
   46    45 S   O    _O17    44     1.22894   119.37289   173.12785
   47    43 S   CA   _C9_    54     1.52598   112.14681    80.68072
   48    43 S   CM   _C15    65     1.51739   114.02179  -152.10060
   49    48 S   HC   _H29    66     1.08803   118.20107   -71.12736
   50    33 S   CT   _C16    45     1.52850   112.91724   160.40787
   51    50 S   HC   _H30    46     1.09968   109.95674  -177.11066
   52    47 S   CA   _C7_    55     1.40501   121.63219    59.09673
   53    52 S   HA   _H24    56     1.08701   120.64885     0.03956
   54    48 S   CM   _C14    67     1.33910   123.98417   109.29114
   55    54 S   HC   _H27    68     1.08509   120.61654   179.94766
   56    54 S   HC   _H28    69     1.08465   121.81455    -0.24708
   57    50 S   OS   _O19    47     1.42318   112.90965   -55.06049
   58    52 S   CA   _C5_    57     1.39633   120.66908   179.82417
   59    58 S   HA   _H22    58     1.08633   119.92079   179.94766
   60    57 S   CT   _C18    48     1.42080   113.51134   -80.11350
   61    60 S   HC   _H32    49     1.09342   108.17542  -177.95254
   62    60 S   HC   _H33    50     1.09318   111.02866    63.35603
   63    60 S   HC   _H34    51     1.09417   110.60859   -59.34470
   64    58 S   CA   _C4_    59     1.39293   120.11725    -0.15577
   65    64 S   HA   _H21    60     1.08613   120.05386  -179.98022
   66    64 S   CA   _C6_    61     1.39288   119.90287    -0.09279
   67    66 S   HA   _H23    62     1.08631   119.98789  -179.90309
   68    47 S   CA   _C8_    63     1.40428   119.86705  -121.48602
   69    68 S   HA   _H25    64     1.08747   120.42988     0.35166
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  12   7   2   1   1  12   4  13  10   4  14   6   5   3  12   6
   3   6   2   8   4   2   1   1   4   6   3   3   2   1   1   5
   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    50    51    57  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    46    50    51    57    60    43  
   38    39    40    45    50    51    57  
   36    37  
   37  
    0  
   39    40    41    42    45    50    51    57    43    44    47    48  
   40    41    50    43  
   41    42    45    46    50    43    44    47    52    68    48    49    54  
   42    45    46    50    51    57    43    44    47    48  
   45    46    50    43  
   44    47    52    53    58    66    68    69    48    49    54    55    56    45  
   47    52    68    48    49    54  
   46    50    51    57    60  
   50    51    57  
   52    53    58    59    64    66    67    68    69    48    49    54  
   49    54    55    56    52    68  
   54    55    56  
   51    57    60    61    62    63  
   57    60  
   53    58    59    64    65    66    68    69  
   58    59    64    68  
   55    56  
   56  
    0  
   60    61    62    63  
   59    64    65    66    67    68  
   64    65    66  
   61    62    63  
   62    63  
   63  
    0  
   65    66    67    68    69  
   66    67    68  
   67    68    69  
   68    69  
   69  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.522
   33    50   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   549.000  1.340
   40    43   317.000  1.510
   41    42   340.000  1.080
   41    45   320.000  1.462
   45    46   570.000  1.229
   45    50   317.000  1.522
   50    51   340.000  1.090
   50    57   320.000  1.410
   57    60   320.000  1.410
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   43    44   340.000  1.090
   43    47   317.000  1.510
   43    48   317.000  1.510
   47    52   469.000  1.400
   47    68   469.000  1.400
   52    53   367.000  1.080
   52    58   469.000  1.400
   58    59   367.000  1.080
   58    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   48    49   340.000  1.080
   48    54   549.000  1.340
   54    55   340.000  1.080
   54    56   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  110.18000
   29    33    50    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    50    45    63.00000  111.10000
   33    50    51    37.50000  110.70000
   33    50    57    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  118.96000
   38    40    43    65.00000  116.34900
   40    38    39    80.00000  123.72100
   40    41    42    35.00000  120.00000
   40    41    45    65.00000  118.96000
   40    43    44    35.00000  109.50000
   40    43    47    70.00000  112.99600
   40    43    48    70.00000  110.12100
   41    45    46    80.00000  123.72100
   41    45    50    65.00000  118.62400
   45    41    42    40.00000  117.72500
   45    50    51    35.00000  109.50000
   45    50    57    90.00000  108.74100
   50    33    34    37.50000  110.70000
   50    33    38    63.00000  111.10000
   50    45    46    80.00000  120.40000
   50    57    60    60.00000  109.50000
   57    50    51    35.00000  109.50000
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   43    40    41    70.00000  124.00000
   43    47    52    70.00000  120.00000
   43    47    68    70.00000  120.00000
   43    48    49    35.00000  117.00000
   43    48    54    70.00000  124.00000
   47    43    44    35.00000  109.50000
   47    52    53    35.00000  120.00000
   47    52    58    63.00000  120.00000
   47    68    66    63.00000  120.00000
   47    68    69    35.00000  120.00000
   52    58    59    35.00000  120.00000
   52    58    64    63.00000  120.00000
   58    52    53    35.00000  120.00000
   58    64    65    35.00000  120.00000
   58    64    66    63.00000  120.00000
   64    58    59    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  120.00000
   68    47    52    63.00000  120.00000
   68    66    67    35.00000  120.00000
   48    43    44    35.00000  109.50000
   48    43    47    70.00000  112.99600
   48    54    55    35.00000  120.00000
   48    54    56    35.00000  120.00000
   54    48    49    35.00000  120.00000
   56    54    55    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    50    45   0.56750  1.0 1.0
   29    33    50    45  -0.07550 -1.0 2.0
   29    33    50    45   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    57   0.56750  1.0 1.0
   29    33    50    57  -0.07550 -1.0 2.0
   29    33    50    57   0.20000  1.0 3.0
   33    38    40    41  -0.33500  1.0 1.0
   33    38    40    41   1.06600 -1.0 2.0
   33    38    40    41  -0.14000  1.0 3.0
   33    38    40    43   0.25700  1.0 1.0
   33    38    40    43   0.66200 -1.0 2.0
   33    38    40    43   0.04450  1.0 3.0
   33    50    57    60   0.06250  1.0 1.0
   33    50    57    60  -0.01100 -1.0 2.0
   33    50    57    60   0.28050  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    50    45  -0.11250  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    57   0.23400  1.0 3.0
   38    33    50    45   0.11950  1.0 1.0
   38    33    50    45   0.20300 -1.0 2.0
   38    33    50    45  -0.70800  1.0 3.0
   38    33    50    51  -0.11250  1.0 3.0
   38    33    50    57  -0.09450  1.0 1.0
   38    33    50    57  -1.12950 -1.0 2.0
   38    33    50    57   0.54000  1.0 3.0
   38    40    41    42   7.00000 -1.0 2.0
   38    40   -41    45   7.00000 -1.0 2.0
   38    40    43    44   0.15000  1.0 3.0
   38    40    43    47   0.09700  1.0 1.0
   38    40    43    47   0.15600 -1.0 2.0
   38    40    43    47  -0.50800  1.0 3.0
   38    40    43    48   0.09700  1.0 1.0
   38    40    43    48   0.15600 -1.0 2.0
   38    40    43    48  -0.50800  1.0 3.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    43  -0.64400  1.0 1.0
   39    38    40    43   0.26850 -1.0 2.0
   40    41    45    46   1.00000 -1.0 2.0
   40    41    45    50  -0.33500  1.0 1.0
   40    41    45    50   1.06600 -1.0 2.0
   40    41    45    50  -0.14000  1.0 3.0
   40    43    47    52   0.18050 -1.0 2.0
   40    43    47    68   0.18050 -1.0 2.0
   40    43    48    49   0.00000  1.0 1.0
   40    43    48    54  -0.28300  1.0 1.0
   40    43    48    54   0.26700 -1.0 2.0
   40    43    48    54  -0.63300  1.0 3.0
   41    40    43    44   0.00000  1.0 1.0
   41    40    43    47   1.44450  1.0 1.0
   41    40    43    47   0.06600 -1.0 2.0
   41    40    43    47   0.29250  1.0 3.0
   41    40    43    48  -0.28300  1.0 1.0
   41    40    43    48   0.26700 -1.0 2.0
   41    40    43    48  -0.63300  1.0 3.0
   41    45   -50    33   0.65300  1.0 1.0
   41    45   -50    33  -0.03850 -1.0 2.0
   41    45   -50    33   0.33900  1.0 3.0
   41    45    50    51   0.00000  1.0 1.0
   41    45    50    57   0.65300  1.0 1.0
   41    45    50    57  -0.03850 -1.0 2.0
   41    45    50    57   0.33900  1.0 3.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    50   0.04550  1.0 1.0
   42    41    45    50   0.83000 -1.0 2.0
   42    41    45    50  -0.04000  1.0 3.0
   45    50    57    60  -1.11000  1.0 1.0
   45    50    57    60   0.50250 -1.0 2.0
   45    50    57    60   0.47450  1.0 3.0
   46    45    50    33   0.30150 -1.0 2.0
   46    45    50    51   0.00000  1.0 1.0
   46    45    50    57   0.30150 -1.0 2.0
   50    33    38    39   0.30150 -1.0 2.0
   50    33   -38    40   0.65300  1.0 1.0
   50    33   -38    40  -0.03850 -1.0 2.0
   50    33   -38    40   0.33900  1.0 3.0
   50    57    60    61   0.37050  1.0 3.0
   50    57    60    62   0.37050  1.0 3.0
   50    57    60    63   0.37050  1.0 3.0
   51    50    57    60   0.37050  1.0 3.0
   43    40    41    42   7.00000 -1.0 2.0
   43    40    41    45   7.00000 -1.0 2.0
   43    47    52    53   3.62500 -1.0 2.0
   43    47    52    58   3.62500 -1.0 2.0
   43    47    68    66   3.62500 -1.0 2.0
   43    47    68    69   3.62500 -1.0 2.0
   43    48    54    55   7.00000 -1.0 2.0
   43    48    54    56   7.00000 -1.0 2.0
   44    43    47    52   0.00000  1.0 1.0
   44    43    47    68   0.00000  1.0 1.0
   44    43    48    49   0.33100  1.0 3.0
   44    43    48    54   0.00000  1.0 1.0
   47    43    48    49   0.00000  1.0 1.0
   47    43    48    54   1.44450  1.0 1.0
   47    43    48    54   0.06600 -1.0 2.0
   47    43    48    54   0.29250  1.0 3.0
   47    52    58    59   3.62500 -1.0 2.0
   47    52    58    64   3.62500 -1.0 2.0
   52    47    68    66   3.62500 -1.0 2.0
   52    47    68    69   3.62500 -1.0 2.0
   52    58    64    65   3.62500 -1.0 2.0
   52    58   -64    66   3.62500 -1.0 2.0
   53    52    58    59   3.62500 -1.0 2.0
   53    52    58    64   3.62500 -1.0 2.0
   58    64    66    67   3.62500 -1.0 2.0
   58    64    66    68   3.62500 -1.0 2.0
   59    58    64    65   3.62500 -1.0 2.0
   59    58    64    66   3.62500 -1.0 2.0
   64    66   -68    47   3.62500 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   67    66    68    47   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   68    47    52    53   3.62500 -1.0 2.0
   68    47   -52    58   3.62500 -1.0 2.0
   48    43    47    52   0.18050 -1.0 2.0
   48    43    47    68   0.18050 -1.0 2.0
   49    48    54    55   7.00000 -1.0 2.0
   49    48    54    56   7.00000 -1.0 2.0
IPHI
    9     5     7     8  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    35    36  10.50000 -1.0 2.0
   33    40    38    39  10.50000 -1.0 2.0
   38    43    40    41   1.10000 -1.0 2.0
   45    42    41    40   1.10000 -1.0 2.0
   41    50    45    46  10.50000 -1.0 2.0
   52    68    47    43   4.00000 -1.0 2.0
   58    53    52    47   1.10000 -1.0 2.0
   64    59    58    52   1.10000 -1.0 2.0
   66    65    64    58   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   66    69    68    47   1.10000 -1.0 2.0
   43    49    48    54  15.00000 -1.0 2.0
   55    56    54    48  15.00000 -1.0 2.0
END
