* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    133    208     397
    1     0 S   NP   _N1_     1    28.71967    97.41975   -22.80362
    2     1 S   H    _HN1     2     1.02828    45.40945   162.83303
    3     1 S   H    _H1_     3     1.02786   101.95865   -93.74210
    4     1 S   H    _H2_     4     1.02949    66.45210    11.27203
    5     1 S   CT   _CA1     5     1.50112   144.17228   103.90933
    6     5 S   HC   _HA1     6     1.09572   105.19470    99.94249
    7     5 S   CO3  _C1_     7     1.53788   112.48171   -20.29568
    8     7 S   O2Z  _O11     8     1.26372   115.00397   -42.10314
    9     7 S   O2Z  _O12     9     1.26241   114.95068   137.04291
   10     5 S   CT   _CB1    10     1.53081   107.42235  -142.06108
   11    10 S   HC   HB11    11     1.09833   109.37451   -49.64908
   12    10 S   HC   HB12    12     1.09812   110.44482    66.96280
   13    10 S   CT   _CG1    13     1.52988   112.60616  -170.62290
   14    13 S   HC   HG11    14     1.09580   110.63470   -65.72532
   15    13 S   HC   HG12    15     1.09671   109.77691    53.50332
   16    13 S   C    _CD1    16     1.51802   112.23290   173.96870
   17    16 S   O    _OE1    17     1.22732   123.27536     7.16106
   18    16 S   N    _N2_    18     1.38643   111.64958  -172.86903
   19    18 S   H    _HN2    19     1.01575   118.96975     1.72986
   20    18 S   CT1  _CA2    20     1.46254   123.47494   177.66200
   21    20 S   HC   _HA2    21     1.09738   109.29378     4.59372
   22    20 S   C    _C2_    22     1.53620   108.81807  -110.87212
   23    22 S   O    _O2_    23     1.23057   122.30170  -149.71800
   24    20 S   CT   _CB2    32     1.53341   111.43866   126.51886
   25    24 S   HC   HB21    33     1.09588   109.98030    55.91686
   26    24 S   HC   HB22    34     1.09471   110.16001   175.07204
   27    22 S   N    _N3_    24     1.38340   113.79924    37.84914
   28    27 S   H    _HN3    25     1.01559   119.57650    -3.40996
   29    24 S   S    _SG2    35     1.82960   111.30851   -64.98321
   30    27 S   CT   _CA3    26     1.45280   123.23701   177.10119
   31    30 S   HC   HA31    27     1.09548   107.51351   -64.60703
   32    30 S   HC   HA32    28     1.09556   107.99129    51.84326
   33    29 S   CT   _C18    36     1.84058    99.60665   170.48017
   34    33 S   HC   _H3_    37     1.09589   105.19939   -51.41978
   35    30 S   CO3  _C3_    29     1.52965   114.05960   173.83496
   36    35 S   O2Z  _O31    30     1.26380   116.06398    -0.71162
   37    35 S   O2Z  _O32    31     1.26428   114.41511   179.35229
   38    33 S   CA   _C9_    38     1.52216   110.93759  -167.86253
   39    33 S   CM   _C10    49     1.51166   110.18141    67.90109
   40    39 S   HC   _H29    50     1.09067   115.77305    54.94622
   41    38 S   CA   _C7_    39     1.40432   119.58268   117.53036
   42    41 S   HA   _H27    40     1.08752   120.38107    -0.52971
   43    39 S   CMA  _C11    51     1.35467   126.55364  -126.72212
   44    43 S   OM   _O16    52     1.26667   126.60697     2.99153
   45    41 S   CA   _C5_    41     1.39650   120.78153   179.16350
   46    45 S   HA   _H25    42     1.08622   119.88066  -179.94065
   47    43 S   OS1  _O22    53     1.41842   110.69419  -178.83165
   48    45 S   CA   _C4_    43     1.39281   120.12099    -0.09487
   49    48 S   HA   _H24    44     1.08596   120.05006  -179.94405
   50    47 S   CO1  _C16    54     1.44273   111.48595   106.71253
   51    50 S   HC   _H34    55     1.09909   109.45482    51.57675
   52    48 S   CA   _C6_    45     1.39264   119.87942    -0.03426
   53    52 S   HA   _H26    46     1.08615   120.01654  -179.86583
   54    50 S   CT   _C14    56     1.53463   107.28878   170.41844
   55    54 S   HC   _H32    57     1.09678   110.01023    53.18583
   56    38 S   CA   _C8_    47     1.40581   122.06514   -63.56734
   57    56 S   HA   _H28    48     1.08731   120.52119     0.68643
   58    54 S   CT   _C12    58     1.53167   111.05462   175.02161
   59    58 S   HC   _H30    59     1.09670   110.17380    73.69430
   60    54 S   OH5  _O20    74     1.42934   110.30364   -63.77050
   61    60 S   HO   _H40    75     0.97242   108.13015   -53.65955
   62    58 S   CT   _C13    60     1.53266   111.49981   -49.05917
   63    62 S   HC   _H31    61     1.09706   109.02369   -71.71706
   64    58 S   OH5  _O18    72     1.42997   109.65385  -170.47430
   65    64 S   HO   _H38    73     0.97237   108.07277    59.85235
   66    62 S   CT   _C15    62     1.53187   110.73342    49.53156
   67    66 S   HC   _H33    63     1.09829   110.99556    64.42087
   68    62 S   OH5  _O19    70     1.42619   109.68779   171.47440
   69    68 S   HO   _H39    71     0.97259   108.11727   -58.45176
   70    50 S   OS1  _O17    64     1.43191   110.96102   -70.17706
   71    66 S   CT   _C17    65     1.52991   111.69295  -174.57563
   72    71 S   HC   _H35    66     1.09512   110.95603    69.91215
   73    71 S   HC   _H36    67     1.09386   111.63725   -52.53486
   74    71 S   OH5  _O21    68     1.42502   109.00796  -171.46372
   75    74 S   HO   _H41    69     0.97211   107.19210  -174.44335
  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   8   5   4   3
  13   6   2   1   1  12   7   3   8   4   6   2   6   3   8   5
   3  13   6   3   2  12   7   1   1  13   7   4   1  12   7   3
   1   9   6   3   1   4   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    56    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    56    57    39    40    43    44    47  
   38    41    56    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    52    53    56    57    39    40    43  
   40    43    44    47    50    41    56  
   43    44    47  
   42    45    46    48    49    52    56    57  
   45    46    48    56  
   44    47    50    51    54    70  
   47    50  
   46    48    49    52    53    56  
   48    49    52  
   50    51    54    55    58    66    70    60  
   49    52    53    56    57  
   52    53    56  
   51    54    55    58    59    62    66    67    70    71    64    60    61  
   54    55    58    66    70    60  
   53    56    57  
   56    57  
   55    58    59    62    63    66    70    68    64    65    60    61  
   58    59    62    70    64    60    61  
   57  
    0  
   59    62    63    66    67    70    71    68    69    64    65    60    61  
   62    63    66    68    64    65    60  
   61    62    64    70  
    0  
   63    66    67    70    71    72    73    74    68    69    64    65  
   66    67    70    71    68    69    64  
   65    66    68  
    0  
   67    70    71    72    73    74    75    68    69  
   70    71    72    73    74    68  
   69    70    71  
    0  
   71    72    73    74  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   2.9000   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.100000   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    56   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   367.000  1.080
   52    56   469.000  1.400
   56    57   367.000  1.080
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   440.000  1.360
   47    50   370.000  1.399
   50    51   360.000  1.097
   50    54   255.000  1.525
   50    70   370.000  1.399
   54    55   340.000  1.090
   54    58   268.000  1.529
   54    60   355.000  1.421
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    64   355.000  1.421
   62    63   340.000  1.090
   62    66   268.000  1.529
   62    68   355.000  1.421
   66    67   340.000  1.090
   66    70   335.000  1.422
   66    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   355.000  1.421
   74    75   580.000  0.967
   68    69   580.000  0.967
   64    65   580.000  0.967
   60    61   580.000  0.967
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    56    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    56    52    63.00000  120.00000
   38    56    57    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    49    35.00000  120.00000
   45    48    52    63.00000  120.00000
   48    45    46    35.00000  120.00000
   48    52    53    35.00000  120.00000
   48    52    56    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    56    57    35.00000  120.00000
   56    38    41    63.00000  120.00000
   56    52    53    35.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    47    50    90.00000  111.18400
   47    43    44    65.00000  121.00000
   47    50    51    60.00000  105.75400
   47    50    54    90.00000  109.70700
   47    50    70   110.00000  113.16000
   50    54    55    45.00000  109.54000
   50    54    58    70.00000  111.10000
   50    54    60    90.00000  109.42000
   50    70    66    90.00000  112.10700
   54    50    51    45.00000  111.65000
   54    58    59    37.50000  110.70000
   54    58    62    58.35000  112.70000
   54    58    64    90.00000  111.45300
   54    60    61    65.00000  108.53500
   58    54    55    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    66    58.35000  112.70000
   58    62    68    90.00000  111.45300
   58    64    65    65.00000  108.53500
   62    58    59    37.50000  110.70000
   62    66    67    37.50000  110.70000
   62    66    70    95.00000  107.88500
   62    66    71    58.35000  112.70000
   62    68    69    65.00000  108.53500
   66    62    63    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    90.00000  111.45300
   70    50    51    60.00000  105.75400
   70    50    54    90.00000  109.70700
   70    66    67    55.00000  108.98800
   71    66    67    37.50000  110.70000
   71    66    70    95.00000  107.88500
   71    74    75    65.00000  108.53500
   73    71    72    33.00000  107.80000
   74    71    72    60.00000  109.39000
   74    71    73    60.00000  109.39000
   68    62    63    60.00000  109.39000
   68    62    66    90.00000  111.45300
   64    58    59    60.00000  109.39000
   64    58    62    90.00000  111.45300
   60    54    55    60.00000  109.39000
   60    54    58    90.00000  111.45300
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    56  -0.16000  1.0 1.0
   29    33    38    56  -0.03200 -1.0 2.0
   29    33    38    56   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    56    52   3.62500 -1.0 2.0
   33    38    56    57   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    56   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    56    52   3.62500 -1.0 2.0
   41    38    56    57   3.62500 -1.0 2.0
   41    45    48    49   3.62500 -1.0 2.0
   41    45   -48    52   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    48    52    53   3.62500 -1.0 2.0
   45    48    52    56   3.62500 -1.0 2.0
   46    45    48    49   3.62500 -1.0 2.0
   46    45    48    52   3.62500 -1.0 2.0
   48    52   -56    38   3.62500 -1.0 2.0
   48    52    56    57   3.62500 -1.0 2.0
   49    48    52    53   3.62500 -1.0 2.0
   49    48    52    56   3.62500 -1.0 2.0
   53    52    56    38   3.62500 -1.0 2.0
   53    52    56    57   3.62500 -1.0 2.0
   56    38    41    42   3.62500 -1.0 2.0
   56    38   -41    45   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    56   0.18050 -1.0 2.0
   39    43    47    50  -2.26850  1.0 1.0
   39    43    47    50   3.39050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    50    51   0.08050  1.0 3.0
   43    47    50    54  -0.46850  1.0 1.0
   43    47    50    54   0.09300 -1.0 2.0
   43    47    50    54  -0.12850  1.0 3.0
   43    47    50    70  -0.48150  1.0 1.0
   43    47    50    70   0.09250 -1.0 2.0
   43    47    50    70  -0.12850  1.0 3.0
   44    43    47    50   2.00000 -1.0 2.0
   47    50    54    55   0.23400  1.0 3.0
   47    50    54    58   0.62750  1.0 1.0
   47    50    54    58  -0.30950 -1.0 2.0
   47    50    54    58   0.27300  1.0 3.0
   47    50    54    60   1.51850  1.0 1.0
   47    50    70    66  -0.70400  1.0 1.0
   47    50    70    66  -0.90350 -1.0 2.0
   50    54    58    59   0.15000  1.0 3.0
   50    54    58    62   0.56750  1.0 1.0
   50    54    58    62  -0.07550 -1.0 2.0
   50    54    58    62   0.20000  1.0 3.0
   50    54    58    64  -0.47750  1.0 1.0
   50    54    60    61   0.29150  1.0 1.0
   50    54    60    61  -0.28350 -1.0 2.0
   50    54    60    61   0.43600  1.0 3.0
   51    50    54    55   0.15000  1.0 3.0
   51    50    54    58   0.15000  1.0 3.0
   51    50    54    60   0.23400  1.0 3.0
   51    50    70    66   0.37050  1.0 3.0
   54    50    70    66   0.06250  1.0 1.0
   54    50    70    66  -0.01100 -1.0 2.0
   54    50    70    66   0.28050  1.0 3.0
   54    58    62    63   0.15000  1.0 3.0
   54    58   -62    66   0.56750  1.0 1.0
   54    58   -62    66  -0.07550 -1.0 2.0
   54    58   -62    66   0.20000  1.0 3.0
   54    58    62    68  -0.47750  1.0 1.0
   54    58    64    65   0.29150  1.0 1.0
   54    58    64    65  -0.28350 -1.0 2.0
   54    58    64    65   0.43600  1.0 3.0
   55    54    58    59   0.15000  1.0 3.0
   55    54    58    62   0.15000  1.0 3.0
   55    54    58    64   0.23400  1.0 3.0
   55    54    60    61   0.19450  1.0 3.0
   58    54    60    61   0.29150  1.0 1.0
   58    54    60    61  -0.28350 -1.0 2.0
   58    54    60    61   0.43600  1.0 3.0
   58    62    66    67   0.15000  1.0 3.0
   58    62    66    70   0.62750  1.0 1.0
   58    62    66    70  -0.30950 -1.0 2.0
   58    62    66    70   0.27300  1.0 3.0
   58    62    66    71   0.56750  1.0 1.0
   58    62    66    71  -0.07550 -1.0 2.0
   58    62    66    71   0.20000  1.0 3.0
   58    62    68    69   0.29150  1.0 1.0
   58    62    68    69  -0.28350 -1.0 2.0
   58    62    68    69   0.43600  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    66   0.15000  1.0 3.0
   59    58    62    68   0.23400  1.0 3.0
   59    58    64    65   0.19450  1.0 3.0
   62    58    64    65   0.29150  1.0 1.0
   62    58    64    65  -0.28350 -1.0 2.0
   62    58    64    65   0.43600  1.0 3.0
   62    66   -70    50   0.06250  1.0 1.0
   62    66   -70    50  -0.01100 -1.0 2.0
   62    66   -70    50   0.28050  1.0 3.0
   62    66    71    72   0.15000  1.0 3.0
   62    66    71    73   0.15000  1.0 3.0
   62    66    71    74  -0.47750  1.0 1.0
   63    62    66    67   0.15000  1.0 3.0
   63    62    66    70   0.23400  1.0 3.0
   63    62    66    71   0.15000  1.0 3.0
   63    62    68    69   0.19450  1.0 3.0
   66    62    68    69   0.29150  1.0 1.0
   66    62    68    69  -0.28350 -1.0 2.0
   66    62    68    69   0.43600  1.0 3.0
   66    71    74    75   0.29150  1.0 1.0
   66    71    74    75  -0.28350 -1.0 2.0
   66    71    74    75   0.43600  1.0 3.0
   67    66    70    50   0.37050  1.0 3.0
   67    66    71    72   0.15000  1.0 3.0
   67    66    71    73   0.15000  1.0 3.0
   67    66    71    74   0.23400  1.0 3.0
   70    50    54    55   0.23400  1.0 3.0
   70    50   -54    58   0.62750  1.0 1.0
   70    50   -54    58  -0.30950 -1.0 2.0
   70    50   -54    58   0.27300  1.0 3.0
   70    50    54    60   1.51850  1.0 1.0
   70    66    71    72   0.23400  1.0 3.0
   70    66    71    73   0.23400  1.0 3.0
   70    66    71    74   1.51850  1.0 1.0
   71    66    70    50   0.06250  1.0 1.0
   71    66    70    50  -0.01100 -1.0 2.0
   71    66    70    50   0.28050  1.0 3.0
   72    71    74    75   0.19450  1.0 3.0
   73    71    74    75   0.19450  1.0 3.0
   68    62    66    67   0.23400  1.0 3.0
   68    62    66    70   1.51850  1.0 1.0
   68    62    66    71  -0.47750  1.0 1.0
   64    58    62    63   0.23400  1.0 3.0
   64    58    62    66  -0.47750  1.0 1.0
   64    58    62    68   3.77950  1.0 1.0
   60    54    58    59   0.23400  1.0 3.0
   60    54    58    62  -0.47750  1.0 1.0
   60    54    58    64   3.77950  1.0 1.0
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
   41    56    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   52    49    48    45   1.10000 -1.0 2.0
   56    53    52    48   1.10000 -1.0 2.0
   52    57    56    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    47    43    39  15.00000 -1.0 2.0
END
