* LIGAND DATABASE FILE (OPLS2005)
*
001      74    77    146    240     432
    1     0 S   NP   _N1_     1    28.70091    93.96579   -21.97222
    2     1 S   H    _HN1     2     1.02779    94.33629   -87.92562
    3     1 S   H    _H1_     3     1.02959    91.92873    20.61289
    4     1 S   H    _H2_     4     1.02837    25.49965   148.25709
    5     1 S   CT   _CA1     5     1.50105   136.18004   143.23024
    6     5 S   HC   _HA1     6     1.09574   105.25242    61.46383
    7     5 S   CO3  _C1_     7     1.53789   112.38133   -58.79633
    8     7 S   O2Z  _O11     8     1.26357   115.00540   -44.52278
    9     7 S   O2Z  _O12     9     1.26237   114.91967   134.72010
   10     5 S   CT   _CB1    10     1.53099   107.44120   179.39251
   11    10 S   HC   HB11    11     1.09824   109.36598   -50.87100
   12    10 S   HC   HB12    12     1.09821   110.40640    65.68467
   13    10 S   CT   _CG1    13     1.53007   112.65524  -171.97393
   14    13 S   HC   HG11    14     1.09599   110.43735   -63.14509
   15    13 S   HC   HG12    15     1.09649   110.00315    56.08351
   16    13 S   C    _CD1    16     1.51801   112.31326   176.46703
   17    16 S   O    _OE1    17     1.22724   123.27372    -2.64345
   18    16 S   N    _N2_    18     1.38641   111.62860   177.45609
   19    18 S   H    _HN2    19     1.01588   119.02617     1.32412
   20    18 S   CT1  _CA2    20     1.46184   123.34373  -179.52317
   21    20 S   HC   _HA2    21     1.09744   109.38279    -9.55350
   22    20 S   C    _C2_    22     1.53447   108.33914  -125.14664
   23    22 S   O    _O2_    23     1.23019   122.21417  -145.38873
   24    20 S   CT   _CB2    32     1.53634   111.67586   112.45736
   25    24 S   HC   HB21    33     1.09530   109.26861    55.65340
   26    24 S   HC   HB22    34     1.09143   109.52865   174.38040
   27    22 S   N    _N3_    24     1.38495   113.40192    41.94432
   28    27 S   H    _HN3    25     1.01517   118.95229    -0.56128
   29    24 S   S    _SG2    35     1.82655   111.31971   -64.41449
   30    27 S   CT   _CA3    26     1.45453   123.43696   174.99402
   31    30 S   HC   HA31    27     1.09523   109.22933    24.61836
   32    30 S   HC   HA32    28     1.09495   107.12664   141.64008
   33    29 S   CT   _C14    36     1.89637   104.22470  -167.15305
   34    30 S   CO3  _C3_    29     1.52931   113.11056   -98.83884
   35    34 S   O2Z  _O31    30     1.26402   115.41037   -43.88793
   36    34 S   O2Z  _O32    31     1.26355   114.97233   137.02158
   37    33 S   CT   _C10    37     1.59415   108.00758  -143.99916
   38    37 S   HC   _H29    38     1.10082   108.87799  -174.41780
   39    33 S   CT   _C16    56     1.57459   110.73350    93.05005
   40    37 S   CT   _C11    39     1.52622   117.70172   -54.13529
   41    40 S   HC   _H30    40     1.09746   111.19881    65.16001
   42    39 S   CT   _C18    57     1.54489   112.58329   -80.06656
   43    42 S   HC   _H36    58     1.09350   112.28683   -56.12469
   44    42 S   HC   _H37    59     1.09736   110.54568  -173.47015
   45    42 S   HC   _H38    60     1.09234   112.23880    66.87619
   46    39 S   OH   _O20    61     1.43913   108.41982   163.52360
   47    46 S   HO   _H40    62     0.97220   108.71686   174.40073
   48    37 S   C3T  _C15    63     1.52414   102.96054    74.89470
   49    40 S   CT   _C9_    41     1.52651   113.59852   -62.41777
   50    49 S   HC   _H28    42     1.09728   111.19297   -44.80731
   51    48 S   C3T  _C12    64     1.49801   107.24800    27.75730
   52    51 S   HC   _H31    65     1.07743   121.10102  -141.83870
   53    48 S   CT   _C17    71     1.48651   123.90454  -120.37357
   54    53 S   HC   _H33    72     1.09576   111.44494   171.90711
   55    53 S   HC   _H34    73     1.09389   111.24274    52.14898
   56    53 S   HC   _H35    74     1.09370   110.90441   -68.77654
   57    49 S   CM   _C4_    43     1.49635    98.41592  -155.63924
   58    49 S   CT   _C7_    50     1.52156   113.13590    79.98057
   59    58 S   HC   _H24    51     1.09747   109.98938   157.45968
   60    58 S   HC   _H25    52     1.09759   109.59725    43.02709
   61    33 S   CT   _C13    66     1.57885   110.67801   -36.37904
   62    61 S   HC   _H32    67     1.09065   113.47709    47.91941
   63    48 S   O3T  _O18    70     1.43498   114.55507    90.15887
   64    57 S   CO4  _C5_    44     1.47998   107.48481    30.11570
   65    64 S   O    _O16    45     1.21689   127.39207   166.11243
   66    57 S   CM   _C6_    47     1.33560   131.24704  -148.61404
   67    66 S   HC   _H22    48     1.08390   121.59371    -1.10924
   68    66 S   HC   _H23    49     1.08554   121.48406   179.22317
   69    58 S   CT   _C8_    53     1.53650   116.52089   -81.52170
   70    69 S   HC   _H26    54     1.09864   106.86176   153.77753
   71    69 S   HC   _H27    55     1.10027   105.98297   -94.86827
   72    61 S   OH   _O19    68     1.42712   111.84198   168.12064
   73    72 S   HO   _H39    69     0.97236   107.46695   170.15462
   74    40 S   OS   _O17    46     1.44541   109.48503  -177.72394
  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  13   5   4   3
  26   2   1   1  24  10  19  17   7  10   4   3   2   6   1  12
  14   8  10   5   5   3   2   1  10   8   4   3   5   3   1   5
   2   3   1   1   2   1   1   1   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    39    61    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    69    39    42    46    48    51    61    62    72  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    49    74    58    69    70    71    39    42    43    44    45    46    47    48    51    52    61    62    72    73    63    53  
   35    36  
   36  
    0  
   38    40    41    49    50    57    64    74    58    69    39    42    46    48    51    52    61    62    72    63    53    54    55    56  
   40    41    49    74    39    48    51    61    63    53  
   42    43    44    45    46    47    48    51    61    62    72    40    49    58    59    60    69    70    71  
   41    49    50    57    64    65    74    66    58    59    60    69    48    51    61    63    53  
   49    50    57    64    74    58    48  
   43    44    45    46    47    61    58    69    70    71  
   44    45    46    69  
   45    46    69  
   46    69  
   47    61    58    69    70    71  
   69  
   51    52    61    62    72    63    53    54    55    56    49    74  
   50    57    64    65    74    66    67    68    58    59    60    69    70    71  
   57    64    74    66    58    59    60    69  
   52    61    62    72    73    63    53    54    55    56  
   61    62    72    63    53  
   54    55    56    61    63  
   55    56    63  
   56    63  
   63  
   64    65    74    66    67    68    58    59    60    69  
   59    60    69    70    71    64    66    74  
   60    69    70    71  
   69    70    71  
   62    72    73    63    69  
   72    73    63  
   72  
   65    74    66    67    68  
   74    66  
   67    68    74  
   68  
    0  
   70    71  
   71  
    0  
   73  
    0  
    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   0.167500   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    39   268.000  1.529
   33    61   268.000  1.529
   37    38   340.000  1.090
   37    40   268.000  1.529
   37    48   275.000  1.510
   40    41   340.000  1.090
   40    49   268.000  1.529
   40    74   320.000  1.410
   49    50   340.000  1.090
   49    57   317.000  1.510
   49    58   268.000  1.529
   57    64   320.000  1.462
   57    66   549.000  1.340
   64    65   570.000  1.229
   64    74   214.000  1.327
   66    67   340.000  1.080
   66    68   340.000  1.080
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    39   268.000  1.529
   39    42   268.000  1.529
   39    46   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
   46    47   553.000  0.945
   48    51   260.000  1.509
   48    63   335.000  1.432
   48    53   275.000  1.510
   51    52   340.000  1.088
   51    61   275.000  1.510
   51    63   335.000  1.432
   61    62   340.000  1.090
   61    72   320.000  1.410
   72    73   553.000  0.945
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    39    75.00000  111.63000
   29    33    61    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    40    58.35000  112.70000
   33    37    48    70.00000  112.37300
   33    39    69    58.35000  112.70000
   33    39    42    58.35000  112.70000
   33    39    46    50.00000  109.50000
   33    61    51    70.00000  112.37300
   33    61    62    37.50000  110.70000
   33    61    72    50.00000  109.50000
   37    40    41    37.50000  110.70000
   37    40    49    58.35000  112.70000
   37    40    74    50.00000  109.50000
   37    48    51    60.00000  120.94000
   37    48    63    80.00000  116.47100
   37    48    53    58.35000  112.70000
   40    37    38    37.50000  110.70000
   40    49    50    37.50000  110.70000
   40    49    57    70.00000  112.02700
   40    49    58    58.35000  112.70000
   40    74    64    83.00000  116.90000
   49    40    41    37.50000  110.70000
   49    57    64    65.00000  116.34900
   49    57    66    70.00000  124.00000
   49    58    59    37.50000  110.70000
   49    58    60    37.50000  110.70000
   49    58    69    58.35000  112.70000
   57    49    50    35.00000  109.50000
   57    64    65    80.00000  123.72100
   57    64    74    90.00000  111.29400
   57    66    67    35.00000  120.00000
   57    66    68    35.00000  120.00000
   74    40    41    35.00000  109.50000
   74    40    49    50.00000  109.50000
   74    64    65    83.00000  123.40000
   66    57    64    65.00000  118.96000
   68    66    67    35.00000  117.00000
   58    49    50    37.50000  110.70000
   58    49    57    70.00000  112.02700
   58    69    70    37.50000  110.70000
   58    69    71    37.50000  110.70000
   58    69    39    58.35000  112.70000
   60    58    59    33.00000  107.80000
   69    58    59    37.50000  110.70000
   69    58    60    37.50000  110.70000
   69    39    42    58.35000  112.70000
   69    39    46    50.00000  109.50000
   71    69    70    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    69    70    37.50000  110.70000
   39    69    71    37.50000  110.70000
   39    42    43    37.50000  110.70000
   39    42    44    37.50000  110.70000
   39    42    45    37.50000  110.70000
   39    46    47    55.00000  108.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
   46    39    42    50.00000  109.50000
   48    37    38    45.00000  109.38400
   48    37    40    70.00000  112.37300
   48    51    52    37.50000  117.20000
   48    51    61    60.00000  120.94000
   48    51    63    15.00000   60.43100
   48    63    51    15.00000   59.14900
   48    53    54    45.00000  109.38400
   48    53    55    45.00000  109.38400
   48    53    56    45.00000  109.38400
   51    61    62    45.00000  109.38400
   51    61    72    50.00000  109.50000
   61    33    37    58.35000  112.70000
   61    33    39    58.35000  112.70000
   61    51    52    40.00000  115.04500
   61    72    73    55.00000  108.50000
   72    61    62    35.00000  109.50000
   63    48    51    15.00000   60.43100
   63    51    52    50.00000  114.27700
   63    51    61    80.00000  116.47100
   53    48    51    60.00000  120.94000
   53    48    63    80.00000  116.47100
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    61   0.01700  1.0 1.0
   24    29    33    61  -0.23550 -1.0 2.0
   24    29    33    61   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    37    38   0.15000  1.0 3.0
   29    33    37    40   0.44750  1.0 1.0
   29    33    37    40  -0.17800 -1.0 2.0
   29    33    37    40   0.20200  1.0 3.0
   29    33    37    48   0.44750  1.0 1.0
   29    33    37    48  -0.17800 -1.0 2.0
   29    33    37    48   0.20200  1.0 3.0
   29    33    39    69   0.44750  1.0 1.0
   29    33    39    69  -0.17800 -1.0 2.0
   29    33    39    69   0.20200  1.0 3.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   29    33    39    46   0.56750  1.0 1.0
   29    33    39    46  -0.07550 -1.0 2.0
   29    33    39    46   0.20000  1.0 3.0
   29    33    61    51   0.44750  1.0 1.0
   29    33    61    51  -0.17800 -1.0 2.0
   29    33    61    51   0.20200  1.0 3.0
   29    33    61    62   0.15000  1.0 3.0
   29    33    61    72   0.56750  1.0 1.0
   29    33    61    72  -0.07550 -1.0 2.0
   29    33    61    72   0.20000  1.0 3.0
   33    37    40    41   0.15000  1.0 3.0
   33    37    40    49   0.56750  1.0 1.0
   33    37    40    49  -0.07550 -1.0 2.0
   33    37    40    49   0.20000  1.0 3.0
   33    37    40    74   0.62750  1.0 1.0
   33    37    40    74  -0.30950 -1.0 2.0
   33    37    40    74   0.27300  1.0 3.0
   33    37   -48    51   0.07850  1.0 1.0
   33    37   -48    51  -0.03950 -1.0 2.0
   33    37   -48    51   0.67350  1.0 3.0
   33    37    48    63   0.02550  1.0 1.0
   33    37    48    63  -0.02600 -1.0 2.0
   33    37    48    63   1.20400  1.0 3.0
   33    37    48    53   0.56750  1.0 1.0
   33    37    48    53  -0.07550 -1.0 2.0
   33    37    48    53   0.20000  1.0 3.0
   33    39    42    43   0.15000  1.0 3.0
   33    39    42    44   0.15000  1.0 3.0
   33    39    42    45   0.15000  1.0 3.0
   33    39    46    47  -0.11600  1.0 1.0
   33    39    46    47  -0.09450 -1.0 2.0
   33    39    46    47   0.21250  1.0 3.0
   33    61    72    73  -0.11600  1.0 1.0
   33    61    72    73  -0.09450 -1.0 2.0
   33    61    72    73   0.21250  1.0 3.0
   37    33    39    69   0.56750  1.0 1.0
   37    33    39    69  -0.07550 -1.0 2.0
   37    33    39    69   0.20000  1.0 3.0
   37    33    39    42   0.56750  1.0 1.0
   37    33    39    42  -0.07550 -1.0 2.0
   37    33    39    42   0.20000  1.0 3.0
   37    33    39    46   0.86500  1.0 1.0
   37    33    39    46  -0.17500 -1.0 2.0
   37    33    39    46   0.20800  1.0 3.0
   37    33   -61    51   0.47050  1.0 1.0
   37    33   -61    51   0.03900 -1.0 2.0
   37    33   -61    51   0.20100  1.0 3.0
   37    33    61    62   0.15000  1.0 3.0
   37    33    61    72   0.86500  1.0 1.0
   37    33    61    72  -0.17500 -1.0 2.0
   37    33    61    72   0.20800  1.0 3.0
   37    40    49    50   0.15000  1.0 3.0
   37    40    49    57   0.34400  1.0 1.0
   37    40    49    57   0.09450 -1.0 2.0
   37    40    49    57   0.11100  1.0 3.0
   37    40    49    58   0.56750  1.0 1.0
   37    40    49    58  -0.07550 -1.0 2.0
   37    40    49    58   0.20000  1.0 3.0
   37    40    74    64  -0.25900  1.0 1.0
   37    40    74    64  -0.47000 -1.0 2.0
   37    40    74    64   0.11750  1.0 3.0
   37    48    51    52   0.15000  1.0 3.0
   37    48   -51    61   0.56750  1.0 1.0
   37    48   -51    61  -0.07550 -1.0 2.0
   37    48   -51    61   0.20000  1.0 3.0
   37    48   -51    63   0.02550  1.0 1.0
   37    48   -51    63  -0.02600 -1.0 2.0
   37    48   -51    63   1.20400  1.0 3.0
   37    48   -63    51   0.06250  1.0 1.0
   37    48   -63    51  -0.01100 -1.0 2.0
   37    48   -63    51   0.28050  1.0 3.0
   37    48    53    54   0.15000  1.0 3.0
   37    48    53    55   0.15000  1.0 3.0
   37    48    53    56   0.15000  1.0 3.0
   38    37    40    41   0.15000  1.0 3.0
   38    37    40    49   0.15000  1.0 3.0
   38    37    40    74   0.23400  1.0 3.0
   38    37    48    51   0.15000  1.0 3.0
   38    37    48    63   0.23400  1.0 3.0
   38    37    48    53   0.15000  1.0 3.0
   40    37    48    51   0.07850  1.0 1.0
   40    37    48    51  -0.03950 -1.0 2.0
   40    37    48    51   0.67350  1.0 3.0
   40    37    48    63   0.02550  1.0 1.0
   40    37    48    63  -0.02600 -1.0 2.0
   40    37    48    63   1.20400  1.0 3.0
   40    37    48    53   0.56750  1.0 1.0
   40    37    48    53  -0.07550 -1.0 2.0
   40    37    48    53   0.20000  1.0 3.0
   40    49   -57    64   0.09700  1.0 1.0
   40    49   -57    64   0.15600 -1.0 2.0
   40    49   -57    64  -0.50800  1.0 3.0
   40    49    57    66   0.09850  1.0 1.0
   40    49    57    66   0.15250 -1.0 2.0
   40    49    57    66  -0.50650  1.0 3.0
   40    49    58    59   0.15000  1.0 3.0
   40    49    58    60   0.15000  1.0 3.0
   40    49    58    69   0.56750  1.0 1.0
   40    49    58    69  -0.07550 -1.0 2.0
   40    49    58    69   0.20000  1.0 3.0
   41    40    49    50   0.15000  1.0 3.0
   41    40    49    57   0.15000  1.0 3.0
   41    40    49    58   0.15000  1.0 3.0
   41    40    74    64   0.08050  1.0 3.0
   49    40   -74    64  -0.25900  1.0 1.0
   49    40   -74    64  -0.47000 -1.0 2.0
   49    40   -74    64   0.11750  1.0 3.0
   49    57    64    65  -0.64400  1.0 1.0
   49    57    64    65   0.26850 -1.0 2.0
   49    57   -64    74  -0.15000  1.0 1.0
   49    57   -64    74   0.89550 -1.0 2.0
   49    57   -64    74  -0.06900  1.0 3.0
   49    57    66    67   7.00000 -1.0 2.0
   49    57    66    68   7.00000 -1.0 2.0
   49    58    69    70   0.15000  1.0 3.0
   49    58    69    71   0.15000  1.0 3.0
   49    58    69    39   0.56750  1.0 1.0
   49    58    69    39  -0.07550 -1.0 2.0
   49    58    69    39   0.20000  1.0 3.0
   50    49    57    64   0.15000  1.0 3.0
   50    49    57    66   0.00000  1.0 1.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    60   0.15000  1.0 3.0
   50    49    58    69   0.15000  1.0 3.0
   57    49    58    59   0.15000  1.0 3.0
   57    49    58    60   0.15000  1.0 3.0
   57    49    58    69   0.34400  1.0 1.0
   57    49    58    69   0.09450 -1.0 2.0
   57    49    58    69   0.11100  1.0 3.0
   57    64   -74    40   2.00000 -1.0 2.0
   64    57    66    67   7.00000 -1.0 2.0
   64    57    66    68   7.00000 -1.0 2.0
   65    64    74    40   3.00000 -1.0 2.0
   74    40    49    50   0.23400  1.0 3.0
   74    40   -49    57   0.61850  1.0 1.0
   74    40   -49    57  -0.22750 -1.0 2.0
   74    40   -49    57   0.15300  1.0 3.0
   74    40    49    58   0.62750  1.0 1.0
   74    40    49    58  -0.30950 -1.0 2.0
   74    40    49    58   0.27300  1.0 3.0
   66    57    64    65   1.00000 -1.0 2.0
   66    57    64    74  -0.56150  1.0 1.0
   66    57    64    74   2.19150 -1.0 2.0
   58    49    57    64   0.09700  1.0 1.0
   58    49    57    64   0.15600 -1.0 2.0
   58    49    57    64  -0.50800  1.0 3.0
   58    49    57    66   0.09850  1.0 1.0
   58    49    57    66   0.15250 -1.0 2.0
   58    49    57    66  -0.50650  1.0 3.0
   58    69    39    33   0.56750  1.0 1.0
   58    69    39    33  -0.07550 -1.0 2.0
   58    69    39    33   0.20000  1.0 3.0
   58    69    39    42   0.56750  1.0 1.0
   58    69    39    42  -0.07550 -1.0 2.0
   58    69    39    42   0.20000  1.0 3.0
   58    69    39    46   0.86500  1.0 1.0
   58    69    39    46  -0.17500 -1.0 2.0
   58    69    39    46   0.20800  1.0 3.0
   59    58    69    70   0.15000  1.0 3.0
   59    58    69    71   0.15000  1.0 3.0
   59    58    69    39   0.15000  1.0 3.0
   60    58    69    70   0.15000  1.0 3.0
   60    58    69    71   0.15000  1.0 3.0
   60    58    69    39   0.15000  1.0 3.0
   69    39    42    43   0.15000  1.0 3.0
   69    39    42    44   0.15000  1.0 3.0
   69    39    42    45   0.15000  1.0 3.0
   69    39    46    47  -0.11600  1.0 1.0
   69    39    46    47  -0.09450 -1.0 2.0
   69    39    46    47   0.21250  1.0 3.0
   70    69    39    33   0.15000  1.0 3.0
   70    69    39    42   0.15000  1.0 3.0
   70    69    39    46   0.23400  1.0 3.0
   71    69    39    33   0.15000  1.0 3.0
   71    69    39    42   0.15000  1.0 3.0
   71    69    39    46   0.23400  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    40   0.56750  1.0 1.0
   39    33    37    40  -0.07550 -1.0 2.0
   39    33    37    40   0.20000  1.0 3.0
   39    33    37    48   0.47050  1.0 1.0
   39    33    37    48   0.03900 -1.0 2.0
   39    33    37    48   0.20100  1.0 3.0
   39    33    61    51   0.47050  1.0 1.0
   39    33    61    51   0.03900 -1.0 2.0
   39    33    61    51   0.20100  1.0 3.0
   39    33    61    62   0.15000  1.0 3.0
   39    33    61    72   0.86500  1.0 1.0
   39    33    61    72  -0.17500 -1.0 2.0
   39    33    61    72   0.20800  1.0 3.0
   42    39    46    47  -0.11600  1.0 1.0
   42    39    46    47  -0.09450 -1.0 2.0
   42    39    46    47   0.21250  1.0 3.0
   46    39    42    43   0.23400  1.0 3.0
   46    39    42    44   0.23400  1.0 3.0
   46    39    42    45   0.23400  1.0 3.0
   48    37    40    41   0.15000  1.0 3.0
   48    37    40    49   0.47050  1.0 1.0
   48    37    40    49   0.03900 -1.0 2.0
   48    37    40    49   0.20100  1.0 3.0
   48    37    40    74  -0.26800  1.0 1.0
   48    37    40    74   0.69150 -1.0 2.0
   48    37    40    74  -0.48750  1.0 3.0
   48    51   -61    33   0.07850  1.0 1.0
   48    51   -61    33  -0.03950 -1.0 2.0
   48    51   -61    33   0.67350  1.0 3.0
   48    51    61    62   0.15000  1.0 3.0
   48    51    61    72   0.86500  1.0 1.0
   48    51    61    72  -0.17500 -1.0 2.0
   48    51    61    72   0.20800  1.0 3.0
   51    48    53    54   0.15000  1.0 3.0
   51    48    53    55   0.15000  1.0 3.0
   51    48    53    56   0.15000  1.0 3.0
   51    61    72    73  -0.11600  1.0 1.0
   51    61    72    73  -0.09450 -1.0 2.0
   51    61    72    73   0.21250  1.0 3.0
   52    51    61    33   0.15000  1.0 3.0
   52    51    61    62   0.15000  1.0 3.0
   52    51    61    72   0.23400  1.0 3.0
   52    51   -63    48   0.36800  1.0 3.0
   61    33    37    38   0.15000  1.0 3.0
   61    33    37    40   0.56750  1.0 1.0
   61    33    37    40  -0.07550 -1.0 2.0
   61    33    37    40   0.20000  1.0 3.0
   61    33   -37    48   0.47050  1.0 1.0
   61    33   -37    48   0.03900 -1.0 2.0
   61    33   -37    48   0.20100  1.0 3.0
   61    33    39    69   0.56750  1.0 1.0
   61    33    39    69  -0.07550 -1.0 2.0
   61    33    39    69   0.20000  1.0 3.0
   61    33    39    42   0.56750  1.0 1.0
   61    33    39    42  -0.07550 -1.0 2.0
   61    33    39    42   0.20000  1.0 3.0
   61    33    39    46   0.86500  1.0 1.0
   61    33    39    46  -0.17500 -1.0 2.0
   61    33    39    46   0.20800  1.0 3.0
   61    51   -63    48   0.06250  1.0 1.0
   61    51   -63    48  -0.01100 -1.0 2.0
   61    51   -63    48   0.28050  1.0 3.0
   62    61    72    73   0.19450  1.0 3.0
   63    48   -51    52   0.23400  1.0 3.0
   63    48   -51    61   0.02550  1.0 1.0
   63    48   -51    61  -0.02600 -1.0 2.0
   63    48   -51    61   1.20400  1.0 3.0
   63    48    53    54   0.23400  1.0 3.0
   63    48    53    55   0.23400  1.0 3.0
   63    48    53    56   0.23400  1.0 3.0
   63    51   -61    33   0.02550  1.0 1.0
   63    51   -61    33  -0.02600 -1.0 2.0
   63    51   -61    33   1.20400  1.0 3.0
   63    51    61    62   0.23400  1.0 3.0
   63    51    61    72   3.69350  1.0 1.0
   63    51    61    72  -1.82950 -1.0 2.0
   53    48    51    52   0.15000  1.0 3.0
   53    48    51    61   0.56750  1.0 1.0
   53    48    51    61  -0.07550 -1.0 2.0
   53    48    51    61   0.20000  1.0 3.0
   53    48   -51    63   0.02550  1.0 1.0
   53    48   -51    63  -0.02600 -1.0 2.0
   53    48   -51    63   1.20400  1.0 3.0
   53    48   -63    51   0.06250  1.0 1.0
   53    48   -63    51  -0.01100 -1.0 2.0
   53    48   -63    51   0.28050  1.0 3.0
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
   49    64    57    66   1.10000 -1.0 2.0
   57    74    64    65  10.50000 -1.0 2.0
   67    68    66    57   1.10000 -1.0 2.0
END
