* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    135    212     392
    1     0 S   NP   _N1_     1    28.98872    96.13160   -19.67779
    2     1 S   H    _HN1     2     1.02809    77.90606   -67.26728
    3     1 S   H    _H1_     3     1.02952    90.24940    41.27961
    4     1 S   H    _H2_     4     1.02853    41.53209   157.36294
    5     1 S   CT   _CA1     5     1.50052   151.03866   178.65652
    6     5 S   HC   _HA1     6     1.09587   105.25695    44.34789
    7     5 S   CO3  _C1_     7     1.53688   112.35978   -75.79355
    8     7 S   O2Z  _O11     8     1.26355   115.23791   -51.40362
    9     7 S   O2Z  _O12     9     1.26282   114.91318   128.20699
   10     5 S   CT   _CB1    10     1.53111   107.46825   161.97867
   11    10 S   HC   HB11    11     1.09817   109.15031   -53.12704
   12    10 S   HC   HB12    12     1.09825   110.53337    63.33343
   13    10 S   CT   _CG1    13     1.53039   112.69122  -174.37158
   14    13 S   HC   HG11    14     1.09572   110.28724   -63.70686
   15    13 S   HC   HG12    15     1.09636   110.14703    55.45761
   16    13 S   C    _CD1    16     1.51807   112.21063   175.55256
   17    16 S   O    _OE1    17     1.22726   123.12760   -10.18101
   18    16 S   N    _N2_    18     1.38601   111.75960   170.58078
   19    18 S   H    _HN2    19     1.01563   119.13197     0.52039
   20    18 S   CT1  _CA2    20     1.46287   123.37159   179.83687
   21    20 S   HC   _HA2    21     1.09747   109.24821   -16.73610
   22    20 S   C    _C2_    22     1.53451   108.09411  -132.18949
   23    22 S   O    _O2_    23     1.22991   122.35209  -145.55803
   24    20 S   CT   _CB2    32     1.53531   111.64083   105.52267
   25    24 S   HC   HB21    33     1.09425   109.67284    54.94162
   26    24 S   HC   HB22    34     1.09483   109.96803   173.32103
   27    22 S   N    _N3_    24     1.38549   113.28626    41.81354
   28    27 S   H    _HN3    25     1.01524   118.93346    -0.27976
   29    24 S   S    _SG2    35     1.83102   111.41668   -67.96231
   30    27 S   CT   _CA3    26     1.45449   123.40202   175.06330
   31    30 S   HC   HA31    27     1.09525   109.20242    25.07661
   32    30 S   HC   HA32    28     1.09493   107.12712   142.09482
   33    29 S   CT   _C11    36     1.87318   101.95083   152.91776
   34    30 S   CO3  _C3_    29     1.52933   113.15204   -98.36384
   35    34 S   O2Z  _O31    30     1.26400   115.42902   -43.28570
   36    34 S   O2Z  _O32    31     1.26357   114.96083   137.65426
   37    33 S   CT   _C7_    37     1.56624   107.48369   169.18726
   38    37 S   HC   _H23    38     1.09592   110.57387   163.07238
   39    37 S   HC   _H24    39     1.09547   113.53788    42.22663
   40    33 S   S    _S21    60     1.85449   109.04580   -69.37633
   41    37 S   C4T  _C10    40     1.53305   104.28906   -78.36939
   42    41 S   HC   _H27    41     1.09809   111.98760    86.87950
   43    40 S   CT   _C14    61     1.82689   102.15079   -65.70021
   44    43 S   HC   _H33    62     1.09372   109.42517    64.99186
   45    43 S   HC   _H34    63     1.09278   109.84921   -54.79701
   46    41 S   C4T  _C8_    42     1.56415   128.46709  -126.01834
   47    46 S   HC   _H25    43     1.09976   112.02538  -147.99673
   48    41 S   N4   _N13    46     1.46986   101.25323   -31.28497
   49    43 S   CT   _C13    64     1.52560   110.47538  -174.41152
   50    49 S   HC   _H31    65     1.09515   109.15536   178.85705
   51    49 S   HC   _H32    66     1.09559   111.53062    59.15314
   52    46 S   C4   _C4_    44     1.55180    85.41336   101.19989
   53    52 S   O    _O17    45     1.20990   136.10788  -174.24486
   54    33 S   CT1  _C9_    47     1.56209   111.10749    57.74321
   55    54 S   HC   _H26    48     1.09410   112.85496   -28.30548
   56    46 S   CT   _C15    52     1.52171   118.99914   -15.48236
   57    56 S   HC   _H35    53     1.09483   111.38102    52.54727
   58    49 S   NG   _N15    67     1.47126   110.22521   -61.62888
   59    58 S   H    _H38    68     1.01621   119.83660    17.34507
   60    54 S   CO3  _C6_    49     1.54777   115.45374  -153.08613
   61    60 S   O2Z  _O16    50     1.26509   114.37796   121.85780
   62    60 S   O2Z  _O18    51     1.26360   116.27443   -57.90433
   63    56 S   CT   _C12    54     1.52167   110.57473   -70.39987
   64    63 S   HC   _H28    55     1.09588   110.94323   -59.36698
   65    63 S   HC   _H29    56     1.09523   110.51446  -177.59800
   66    63 S   HC   _H30    57     1.09377   111.70989    61.44945
   67    56 S   OH   _O19    58     1.42591   108.16854   170.89936
   68    67 S   HO   _H39    59     0.97244   107.44187  -175.44775
   69    58 S   CG   _C5_    69     1.32551   123.37606  -163.97379
   70    69 S   HC   _H22    70     1.07834   115.75911  -179.80820
   71    69 S   NG   _N14    71     1.32132   128.51775     0.41825
   72    71 S   H    _H36    72     1.01365   120.19804   178.55531
   73    71 S   H    _H37    73     1.01246   121.25344     1.52649
  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  11   5   4   3
  18   2   1   1  14   7   6  12  13   6   9   5   4  13   7   8
   7   4   3   8   2   4   3   7   6   6   3   2   1   1   5   3
   2   1   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    48    54    55    60    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    46    52    48    54    55    60    61    62    40    43    44    45    49  
   35    36  
   36  
    0  
   38    39    41    42    46    47    52    48    54    55    60    56    40    43  
   39    41    42    46    48    54    40  
   41    42    46    48    54    40  
   43    44    45    49    50    51    58    41    48    54    55    60  
   42    46    47    52    53    48    54    55    60    56    57    63    67  
   46    47    52    48    54    56  
   44    45    49    50    51    58    59    69    54  
   45    49    50    51    58  
   49    50    51    58  
   47    52    53    48    54    56    57    63    64    65    66    67    68  
   52    53    48    56    57    63    67  
   54    55    60    61    62    56    52    53  
   50    51    58    59    69    70    71  
   51    58    59    69  
   58    59    69  
   53    54    55    60    56    57    63    67  
   54    56  
   55    60    61    62  
   60    61    62  
   57    63    64    65    66    67    68  
   63    64    65    66    67    68  
   59    69    70    71    72    73  
   69    70    71  
   61    62  
   62  
    0  
   64    65    66    67    68  
   65    66    67  
   66    67  
   67  
   68  
    0  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    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   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5000   0.0660   0.192400   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   54   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.2500   0.1700  -0.340900   2.2900   2.0360   0.003973653   1.685851020
   59   0.0000   0.0000   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   60   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
   69   2.2500   0.0500   0.371400   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.139100   1.4250   1.2500   0.008598240   0.268726247
   71   3.2500   0.1700  -0.747100   1.8650   1.6500   0.051222218  -2.220205820
   72   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   73   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    54   268.000  1.529
   33    40   222.000  1.810
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    41   260.000  1.519
   41    42   340.000  1.090
   41    46   268.000  1.529
   41    48   305.000  1.456
   46    47   340.000  1.090
   46    52   250.000  1.540
   46    56   260.000  1.519
   52    53   930.000  1.212
   52    48   440.000  1.369
   48    54   337.000  1.449
   54    55   340.000  1.090
   54    60   317.000  1.522
   60    61   656.000  1.250
   60    62   656.000  1.250
   56    57   340.000  1.090
   56    63   268.000  1.529
   56    67   320.000  1.410
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   553.000  0.945
   40    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   337.000  1.463
   58    59   434.000  1.010
   58    69   481.000  1.340
   69    70   385.000  1.083
   69    71   481.000  1.340
   71    72   434.000  1.010
   71    73   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    54    75.00000  108.68000
   29    33    40    75.00000  118.28000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    41    70.00000  112.98000
   33    54    48    80.00000  109.70000
   33    54    55    37.50000  110.70000
   33    54    60    63.00000  111.10000
   33    40    43    62.00000   98.90000
   37    41    42    45.00000  112.72800
   37    41    46    65.00000  119.52000
   37    41    48    80.00000  110.05700
   39    37    38    33.00000  107.80000
   41    37    38    45.00000  111.22300
   41    37    39    45.00000  111.22300
   41    46    47    37.50000  110.70000
   41    46    52   100.00000   86.36000
   41    46    56    65.00000  119.52000
   41    48    52   100.00000   93.00000
   41    48    54    50.00000  132.70000
   46    41    42    37.50000  110.70000
   46    52    53    60.00000  136.58000
   46    52    48    95.00000   92.72400
   46    56    57    45.00000  111.22300
   46    56    63    70.00000  112.98000
   46    56    67    50.00000  109.50000
   52    46    47    40.00000  113.37500
   52    48    54    50.00000  132.10000
   48    41    42    50.00000  112.01000
   48    41    46   105.00000   87.49700
   48    52    53    75.00000  131.60000
   48    54    55    35.00000  109.50000
   48    54    60    63.00000  110.10000
   54    33    37    58.35000  112.70000
   54    60    61    70.00000  117.00000
   54    60    62    70.00000  117.00000
   60    54    55    35.00000  109.50000
   62    60    61    80.00000  126.00000
   56    46    47    45.00000  112.72800
   56    46    52    63.00000  111.10000
   56    63    64    37.50000  110.70000
   56    63    65    37.50000  110.70000
   56    63    66    37.50000  110.70000
   56    67    68    55.00000  108.50000
   63    56    57    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    56    57    35.00000  109.50000
   67    56    63    50.00000  109.50000
   40    33    37    75.00000  111.63000
   40    33    54    75.00000  108.68000
   40    43    44    35.00000  109.50000
   40    43    45    35.00000  109.50000
   40    43    49    75.00000  111.63000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    58    80.00000  111.20000
   45    43    44    33.00000  107.80000
   49    43    44    37.50000  110.70000
   49    43    45    37.50000  110.70000
   49    58    59    35.00000  118.40000
   49    58    69    50.00000  123.20000
   51    49    50    33.00000  107.80000
   58    49    50    35.00000  109.50000
   58    49    51    35.00000  109.50000
   58    69    70    45.00000  116.52200
   58    69    71    70.00000  120.00000
   69    58    59    35.00000  120.00000
   69    71    72    35.00000  120.00000
   69    71    73    35.00000  120.00000
   71    69    70    45.00000  116.52200
   73    71    72    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    40   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
   29    33    54    48   0.71400  1.0 1.0
   29    33    54    48   0.04300 -1.0 2.0
   29    33    54    48   0.01450  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    60  -2.17200  1.0 1.0
   29    33    54    60  -0.85700 -1.0 2.0
   29    33    40    43   0.08500  1.0 1.0
   29    33    40    43  -0.53150 -1.0 2.0
   29    33    40    43   0.48050  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    46   0.04050  1.0 1.0
   33    37    41    46   0.63700 -1.0 2.0
   33    37    41    46   0.17650  1.0 3.0
   33    37   -41    48   0.43900  1.0 1.0
   33    37   -41    48   0.49100 -1.0 2.0
   33    37   -41    48   0.28400  1.0 3.0
   33    54    60    61   0.00000  1.0 1.0
   33    54    60    62   0.00000  1.0 1.0
   33    40    43    44   0.32350  1.0 3.0
   33    40    43    45   0.32350  1.0 3.0
   33    40    43    49   0.01700  1.0 1.0
   33    40    43    49  -0.23550 -1.0 2.0
   33    40    43    49   0.21350  1.0 3.0
   37    33   -54    48   0.42250  1.0 1.0
   37    33   -54    48  -0.48100 -1.0 2.0
   37    33   -54    48   0.35650  1.0 3.0
   37    33    54    55   0.15000  1.0 3.0
   37    33    54    60  -0.84850  1.0 1.0
   37    33    54    60  -0.22800 -1.0 2.0
   37    33    54    60   0.29250  1.0 3.0
   37    33    40    43   0.01700  1.0 1.0
   37    33    40    43  -0.23550 -1.0 2.0
   37    33    40    43   0.21350  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    52  -0.95700  1.0 1.0
   37    41    46    52  -0.18200 -1.0 2.0
   37    41    46    52   0.29450  1.0 3.0
   37    41    46    56   0.56750  1.0 1.0
   37    41    46    56  -0.07550 -1.0 2.0
   37    41    46    56   0.20000  1.0 3.0
   37    41   -48    52   0.00000  1.0 1.0
   37    41   -48    54   0.00000  1.0 1.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    46   0.00000  1.0 1.0
   38    37    41    48   0.15000  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    46   0.00000  1.0 1.0
   39    37    41    48   0.15000  1.0 3.0
   41    46    52    53  -0.11250  1.0 1.0
   41    46    52    53   0.11400 -1.0 2.0
   41    46    52    53  -0.28950  1.0 3.0
   41    46   -52    48   3.00000 -1.0 2.0
   41    46    56    57   0.00000  1.0 1.0
   41    46    56    63   0.04050  1.0 1.0
   41    46    56    63   0.63700 -1.0 2.0
   41    46    56    63   0.17650  1.0 3.0
   41    46    56    67   0.86500  1.0 1.0
   41    46    56    67  -0.17500 -1.0 2.0
   41    46    56    67   0.20800  1.0 3.0
   41    48   -54    33   0.00000  1.0 1.0
   41    48    54    55   0.00000  1.0 1.0
   41    48    54    60   0.00000  1.0 1.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    52   0.15000  1.0 3.0
   42    41    46    56   0.15000  1.0 3.0
   42    41   -48    52   0.00000  1.0 1.0
   42    41    48    54   0.00000  1.0 1.0
   46    41   -48    52   0.00000  1.0 1.0
   46    41    48    54   0.00000  1.0 1.0
   46    52   -48    41   3.00000 -1.0 2.0
   46    52   -48    54   3.00000 -1.0 2.0
   46    56    63    64   0.15000  1.0 3.0
   46    56    63    65   0.15000  1.0 3.0
   46    56    63    66   0.15000  1.0 3.0
   46    56    67    68  -0.11600  1.0 1.0
   46    56    67    68  -0.09450 -1.0 2.0
   46    56    67    68   0.21250  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    48   0.00000  1.0 1.0
   47    46    56    57   0.15000  1.0 3.0
   47    46    56    63   0.15000  1.0 3.0
   47    46    56    67   0.23400  1.0 3.0
   52    46    56    57  -0.11250  1.0 3.0
   52    46    56    63  -0.95700  1.0 1.0
   52    46    56    63  -0.18200 -1.0 2.0
   52    46    56    63   0.29450  1.0 3.0
   52    46    56    67  -0.09450  1.0 1.0
   52    46    56    67  -1.12950 -1.0 2.0
   52    46    56    67   0.54000  1.0 3.0
   52    48    54    33   0.00000  1.0 1.0
   52    48    54    55   0.00000  1.0 1.0
   52    48    54    60   0.00000  1.0 1.0
   53    52   -48    41   3.00000 -1.0 2.0
   53    52    48    54   3.00000 -1.0 2.0
   48    41   -46    47   0.15000  1.0 3.0
   48    41   -46    52   3.00000 -1.0 2.0
   48    41    46    56   0.43900  1.0 1.0
   48    41    46    56   0.49100 -1.0 2.0
   48    41    46    56   0.28400  1.0 3.0
   48    54    60    61   0.00000  1.0 1.0
   48    54    60    62   0.00000  1.0 1.0
   54    33    37    38   0.15000  1.0 3.0
   54    33    37    39   0.15000  1.0 3.0
   54    33   -37    41   0.31550 -1.0 2.0
   54    33   -37    41   0.11250  1.0 3.0
   54    33    40    43   0.01700  1.0 1.0
   54    33    40    43  -0.23550 -1.0 2.0
   54    33    40    43   0.21350  1.0 3.0
   55    54    60    61   0.00000  1.0 1.0
   55    54    60    62   0.00000  1.0 1.0
   56    46    52    53   0.30150 -1.0 2.0
   56    46   -52    48   1.39750  1.0 1.0
   56    46   -52    48  -0.07950 -1.0 2.0
   56    46   -52    48  -0.18750  1.0 3.0
   57    56    63    64   0.15000  1.0 3.0
   57    56    63    65   0.15000  1.0 3.0
   57    56    63    66   0.15000  1.0 3.0
   57    56    67    68   0.19450  1.0 3.0
   63    56    67    68  -0.11600  1.0 1.0
   63    56    67    68  -0.09450 -1.0 2.0
   63    56    67    68   0.21250  1.0 3.0
   67    56    63    64   0.23400  1.0 3.0
   67    56    63    65   0.23400  1.0 3.0
   67    56    63    66   0.23400  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    41   0.44750  1.0 1.0
   40    33    37    41  -0.17800 -1.0 2.0
   40    33    37    41   0.20200  1.0 3.0
   40    33    54    48   0.71400  1.0 1.0
   40    33    54    48   0.04300 -1.0 2.0
   40    33    54    48   0.01450  1.0 3.0
   40    33    54    55   0.15000  1.0 3.0
   40    33    54    60  -2.17200  1.0 1.0
   40    33    54    60  -0.85700 -1.0 2.0
   40    43    49    50   0.15000  1.0 3.0
   40    43    49    51   0.15000  1.0 3.0
   40    43    49    58   0.56750  1.0 1.0
   40    43    49    58  -0.07550 -1.0 2.0
   40    43    49    58   0.20000  1.0 3.0
   43    49    58    59  -0.09500  1.0 1.0
   43    49    58    59  -0.20850 -1.0 2.0
   43    49    58    59   0.20900  1.0 3.0
   43    49    58    69   0.25550 -1.0 2.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    58  -0.29100  1.0 3.0
   45    43    49    50   0.15000  1.0 3.0
   45    43    49    51   0.15000  1.0 3.0
   45    43    49    58  -0.29100  1.0 3.0
   49    58    69    70  -0.09200  1.0 1.0
   49    58    69    70   0.68550 -1.0 2.0
   49    58    69    71   3.96800 -1.0 2.0
   50    49    58    59   0.00000  1.0 1.0
   50    49    58    69   0.08850  1.0 3.0
   51    49    58    59   0.00000  1.0 1.0
   51    49    58    69   0.08850  1.0 3.0
   58    69    71    72   1.50000 -1.0 2.0
   58    69    71    73   1.50000 -1.0 2.0
   59    58    69    70   1.00000 -1.0 2.0
   59    58    69    71   1.50000 -1.0 2.0
   70    69    71    72   1.00000 -1.0 2.0
   70    69    71    73   1.00000 -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
   36    30    34    35  10.50000 -1.0 2.0
   46    48    52    53  10.50000 -1.0 2.0
   54    52    48    41   1.00000 -1.0 2.0
   61    54    60    62  10.50000 -1.0 2.0
   49    59    58    69   1.00000 -1.0 2.0
   71    70    69    58  10.50000 -1.0 2.0
   73    69    71    72   1.00000 -1.0 2.0
END
