* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    143    227     425
    1     0 S   NP   _N1_     1    29.24972    92.06439   -21.73808
    2     1 S   H    _HN1     2     1.02772    98.82773   -71.54056
    3     1 S   H    _H1_     3     1.02970    98.64916    38.67106
    4     1 S   H    _H2_     4     1.02828    15.85323   161.94960
    5     1 S   CT   _CA1     5     1.50153   126.61430   162.07433
    6     5 S   HC   _HA1     6     1.09581   105.20172    59.12636
    7     5 S   CO3  _C1_     7     1.53780   112.44047   -60.90534
    8     7 S   O2Z  _O11     8     1.26348   115.01821   -41.73156
    9     7 S   O2Z  _O12     9     1.26254   114.91673   137.35688
   10     5 S   CT   _CB1    10     1.53076   107.34422   176.89587
   11    10 S   HC   HB11    11     1.09819   109.14583   -51.72248
   12    10 S   HC   HB12    12     1.09820   110.41805    64.70396
   13    10 S   CT   _CG1    13     1.53018   112.83112  -172.99162
   14    13 S   HC   HG11    14     1.09594   110.26514   -64.89433
   15    13 S   HC   HG12    15     1.09637   110.16902    54.36104
   16    13 S   C    _CD1    16     1.51784   112.21241   174.44191
   17    16 S   O    _OE1    17     1.22757   123.19125    -9.48572
   18    16 S   N    _N2_    18     1.38697   111.79913   171.23642
   19    18 S   H    _HN2    19     1.01588   119.16014     0.68414
   20    18 S   CT1  _CA2    20     1.46067   123.10179  -178.88706
   21    20 S   HC   _HA2    21     1.09565   109.09354   -12.60223
   22    20 S   C    _C2_    22     1.53416   108.86150  -127.66700
   23    22 S   O    _O2_    23     1.23029   122.11218  -148.18777
   24    20 S   CT   _CB2    32     1.53533   111.96899   109.70047
   25    24 S   HC   HB21    33     1.09660   109.48018    64.81850
   26    24 S   HC   HB22    34     1.09578   110.78568  -178.00669
   27    22 S   N    _N3_    24     1.38478   113.45335    39.44444
   28    27 S   H    _HN3    25     1.01520   118.91570    -0.78584
   29    24 S   S    _SG2    35     1.82860   114.99846   -54.82788
   30    27 S   CT   _CA3    26     1.45439   123.39114   174.57061
   31    30 S   HC   HA31    27     1.09529   109.12245    26.35665
   32    30 S   HC   HA32    28     1.09489   107.14499   143.39464
   33    29 S   CT   _C18    36     1.82503   100.06146   -67.98517
   34    33 S   HC   _H3_    37     1.09486   107.49284   -66.69956
   35    33 S   HC   _H4_    38     1.09249   109.43436    50.82485
   36    30 S   CO3  _C3_    29     1.52957   113.23933   -96.99852
   37    36 S   O2Z  _O31    30     1.26396   115.50341   -41.15080
   38    36 S   O2Z  _O32    31     1.26368   114.90884   139.77325
   39    33 S   CT   _C12    39     1.53231   111.04893   172.79312
   40    39 S   HC   _H29    40     1.09587   111.74661    47.34291
   41    39 S   CO4  _C6_    41     1.51526   111.11734   -76.06999
   42    41 S   O    _O16    42     1.22149   125.76947    78.55270
   43    41 S   OS   _O17    43     1.36818   110.28235  -100.90940
   44    43 S   CT   _C11    44     1.43149   109.61336     2.84207
   45    44 S   HC   _H28    45     1.09721   107.55001    94.70448
   46    44 S   CM   _C4_    46     1.49377   109.67929  -147.43374
   47    46 S   HC   _H19    47     1.08754   115.85446   -70.61600
   48    39 S   CT   _C13    64     1.53233   111.82627   171.49869
   49    48 S   HC   _H30    65     1.09605   111.94628   -30.94153
   50    46 S   CM   _C5_    48     1.34542   124.44548   112.66788
   51    50 S   CT   _C7_    49     1.50993   120.30208   174.49729
   52    51 S   HC   _H20    50     1.09695   108.89253  -108.70246
   53    51 S   HC   _H21    51     1.09675   111.33862     8.21664
   54    51 S   CT   _C8_    52     1.52195   111.79557   130.11501
   55    54 S   HC   _H22    53     1.09605   109.59515   175.44551
   56    54 S   HC   _H23    54     1.09736   109.82047   -67.44644
   57    54 S   CT   _C9_    55     1.52407   111.31923    54.10207
   58    57 S   HC   _H24    56     1.09650   109.79449    65.72384
   59    57 S   HC   _H25    57     1.09705   108.71793  -178.13208
   60    57 S   CT   _C14    58     1.54015   111.33336   -57.10663
   61    60 S   HC   _H31    59     1.10051   106.18007   -62.74212
   62    50 S   CT   _C15    60     1.53299   122.69480    -4.56742
   63    60 S   CT   _C16    70     1.53469   108.98402  -177.02297
   64    63 S   HC   _H32    71     1.09445   111.78773   -61.89802
   65    63 S   HC   _H33    72     1.09338   111.76509   176.33302
   66    63 S   HC   _H34    73     1.09592   110.30452    57.41462
   67    62 S   CT   _C10    61     1.56006   110.14197   -15.31687
   68    67 S   HC   _H26    62     1.09918   109.20651   -76.77435
   69    67 S   HC   _H27    63     1.09727   110.36204   167.17405
   70    62 S   CT   _C17    66     1.54538   108.11998   103.73959
   71    70 S   HC   _H35    67     1.09533   111.52128  -171.45291
   72    70 S   HC   _H36    68     1.09481   112.11350    67.99880
   73    70 S   HC   _H37    69     1.09621   111.62132   -51.83777
  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   7   5   4   3
  11   5   4   2   1   1  13   7   8   3   8  11   6  12   4   8
   4  18  12   6   5   9   5   4  11   5   4  13   7  11   5   2
   1   1   6   2   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    67    48    49  
   35    39    40    41    48  
   39    40    41    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    62    67    68    69    48    49  
   41    42    43    44    67    48    49  
   42    43    44    45    46    67    48    49  
   43    44    48  
   44    45    46    47    50    67    48    49  
   45    46    47    50    51    62    67    68    69    48    49  
   46    47    50    67    48    49  
   47    50    51    52    53    54    60    62    67    48    49    70  
   50    51    62    48  
   49    70    50    60    62    67    68    69  
   62    67    68    69  
   51    52    53    54    55    56    57    60    61    62    67    68    69    70    71    72    73    63  
   52    53    54    55    56    57    58    59    60    62    67    70  
   53    54    55    56    57    62  
   54    55    56    57    62  
   55    56    57    58    59    60    61    62    63  
   56    57    58    59    60  
   57    58    59    60  
   58    59    60    61    62    67    70    63    64    65    66  
   59    60    61    62    63  
   60    61    62    63  
   61    62    67    68    69    70    71    72    73    63    64    65    66  
   62    67    70    63    64    65    66  
   67    68    69    70    71    72    73    63    64    65    66  
   64    65    66    67    70  
   65    66  
   66  
    0  
   68    69    70    71    72    73  
   69    70  
   70  
   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    48   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   317.000  1.510
   44    48   268.000  1.529
   46    47   340.000  1.080
   46    50   549.000  1.340
   50    51   317.000  1.510
   50    62   317.000  1.510
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   268.000  1.529
   60    63   268.000  1.529
   62    67   268.000  1.529
   62    70   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    48   268.000  1.529
   48    49   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    48    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    48    44    58.35000  112.70000
   39    48    67    58.35000  112.70000
   39    48    49    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    85.00000  110.90400
   43    44    48    50.00000  109.50000
   44    46    47    35.00000  117.00000
   44    46    50    70.00000  124.00000
   44    48    67    58.35000  112.70000
   44    48    49    37.50000  110.70000
   46    44    45    35.00000  109.50000
   46    50    51    70.00000  124.00000
   46    50    62    70.00000  124.00000
   50    46    47    35.00000  120.00000
   50    51    52    35.00000  109.50000
   50    51    53    35.00000  109.50000
   50    51    54    70.00000  112.02700
   50    62    60    70.00000  112.02700
   50    62    67    70.00000  112.02700
   50    62    70    70.00000  112.02700
   51    54    55    37.50000  110.70000
   51    54    56    37.50000  110.70000
   51    54    57    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    37.50000  110.70000
   54    51    53    37.50000  110.70000
   54    57    58    37.50000  110.70000
   54    57    59    37.50000  110.70000
   54    57    60    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    37.50000  110.70000
   57    54    56    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    62    58.35000  112.70000
   57    60    63    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    62    67    58.35000  112.70000
   60    62    70    58.35000  112.70000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    37.50000  110.70000
   62    50    51    65.00000  117.92700
   62    60    61    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    48    58.35000  112.70000
   62    70    71    37.50000  110.70000
   62    70    72    37.50000  110.70000
   62    70    73    37.50000  110.70000
   67    48    49    37.50000  110.70000
   69    67    68    33.00000  107.80000
   48    39    40    37.50000  110.70000
   48    39    41    63.00000  111.10000
   48    44    45    37.50000  110.70000
   48    44    46    70.00000  112.02700
   48    67    68    37.50000  110.70000
   48    67    69    37.50000  110.70000
   70    62    67    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    36    37   0.00000  1.0 1.0
   27    30    36    38   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    48   0.44750  1.0 1.0
   29    33    39    48  -0.17800 -1.0 2.0
   29    33    39    48   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    48    44   0.56750  1.0 1.0
   33    39    48    44  -0.07550 -1.0 2.0
   33    39    48    44   0.20000  1.0 3.0
   33    39    48    67   0.56750  1.0 1.0
   33    39    48    67  -0.07550 -1.0 2.0
   33    39    48    67   0.20000  1.0 3.0
   33    39    48    49   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    48   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    48   0.15000  1.0 3.0
   39    41   -43    44   1.63150  1.0 1.0
   39    41   -43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    48    44   0.15000  1.0 3.0
   40    39    48    67   0.15000  1.0 3.0
   40    39    48    49   0.15000  1.0 3.0
   41    39   -48    44  -0.95700  1.0 1.0
   41    39   -48    44  -0.18200 -1.0 2.0
   41    39   -48    44   0.29450  1.0 3.0
   41    39    48    67  -0.95700  1.0 1.0
   41    39    48    67  -0.18200 -1.0 2.0
   41    39    48    67   0.29450  1.0 3.0
   41    39    48    49  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.82050  1.0 1.0
   41    43    44    46   0.00600 -1.0 2.0
   41    43    44    46   0.04400  1.0 3.0
   41    43   -44    48  -0.25900  1.0 1.0
   41    43   -44    48  -0.47000 -1.0 2.0
   41    43   -44    48   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    46    47   0.00000  1.0 1.0
   43    44    46    50   0.39000  1.0 1.0
   43    44    46    50  -0.05800 -1.0 2.0
   43    44    46    50  -0.55150  1.0 3.0
   43    44   -48    39   0.62750  1.0 1.0
   43    44   -48    39  -0.30950 -1.0 2.0
   43    44   -48    39   0.27300  1.0 3.0
   43    44    48    67   0.62750  1.0 1.0
   43    44    48    67  -0.30950 -1.0 2.0
   43    44    48    67   0.27300  1.0 3.0
   43    44    48    49   0.23400  1.0 3.0
   44    46    50    51   7.00000 -1.0 2.0
   44    46    50    62   7.00000 -1.0 2.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    50   0.00000  1.0 1.0
   45    44    48    39   0.15000  1.0 3.0
   45    44    48    67   0.15000  1.0 3.0
   45    44    48    49   0.15000  1.0 3.0
   46    44    48    39   0.34400  1.0 1.0
   46    44    48    39   0.09450 -1.0 2.0
   46    44    48    39   0.11100  1.0 3.0
   46    44    48    67   0.34400  1.0 1.0
   46    44    48    67   0.09450 -1.0 2.0
   46    44    48    67   0.11100  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    50    51    52   0.00000  1.0 1.0
   46    50    51    53   0.00000  1.0 1.0
   46    50    51    54   0.09850  1.0 1.0
   46    50    51    54   0.15250 -1.0 2.0
   46    50    51    54  -0.50650  1.0 3.0
   46    50    62    60   0.09850  1.0 1.0
   46    50    62    60   0.15250 -1.0 2.0
   46    50    62    60  -0.50650  1.0 3.0
   46    50   -62    67   0.09850  1.0 1.0
   46    50   -62    67   0.15250 -1.0 2.0
   46    50   -62    67  -0.50650  1.0 3.0
   46    50    62    70   0.09850  1.0 1.0
   46    50    62    70   0.15250 -1.0 2.0
   46    50    62    70  -0.50650  1.0 3.0
   47    46    50    51   7.00000 -1.0 2.0
   47    46    50    62   7.00000 -1.0 2.0
   50    51    54    55   0.15000  1.0 3.0
   50    51    54    56   0.15000  1.0 3.0
   50    51    54    57   0.34400  1.0 1.0
   50    51    54    57   0.09450 -1.0 2.0
   50    51    54    57   0.11100  1.0 3.0
   50    62    67    68   0.15000  1.0 3.0
   50    62    67    69   0.15000  1.0 3.0
   50    62    67    48   0.34400  1.0 1.0
   50    62    67    48   0.09450 -1.0 2.0
   50    62    67    48   0.11100  1.0 3.0
   50    62    70    71   0.15000  1.0 3.0
   50    62    70    72   0.15000  1.0 3.0
   50    62    70    73   0.15000  1.0 3.0
   51    50    62    60   0.46850  1.0 1.0
   51    50    62    60   0.08550 -1.0 2.0
   51    50    62    60   0.09800  1.0 3.0
   51    50    62    67   0.46850  1.0 1.0
   51    50    62    67   0.08550 -1.0 2.0
   51    50    62    67   0.09800  1.0 3.0
   51    50    62    70   0.46850  1.0 1.0
   51    50    62    70   0.08550 -1.0 2.0
   51    50    62    70   0.09800  1.0 3.0
   51    54    57    58   0.15000  1.0 3.0
   51    54    57    59   0.15000  1.0 3.0
   51    54   -57    60   0.56750  1.0 1.0
   51    54   -57    60  -0.07550 -1.0 2.0
   51    54   -57    60   0.20000  1.0 3.0
   52    51    54    55   0.15000  1.0 3.0
   52    51    54    56   0.15000  1.0 3.0
   52    51    54    57   0.15000  1.0 3.0
   53    51    54    55   0.15000  1.0 3.0
   53    51    54    56   0.15000  1.0 3.0
   53    51    54    57   0.15000  1.0 3.0
   54    57    60    61   0.15000  1.0 3.0
   54    57    60    62   0.56750  1.0 1.0
   54    57    60    62  -0.07550 -1.0 2.0
   54    57    60    62   0.20000  1.0 3.0
   54    57    60    63   0.56750  1.0 1.0
   54    57    60    63  -0.07550 -1.0 2.0
   54    57    60    63   0.20000  1.0 3.0
   55    54    57    58   0.15000  1.0 3.0
   55    54    57    59   0.15000  1.0 3.0
   55    54    57    60   0.15000  1.0 3.0
   56    54    57    58   0.15000  1.0 3.0
   56    54    57    59   0.15000  1.0 3.0
   56    54    57    60   0.15000  1.0 3.0
   57    60   -62    50   0.34400  1.0 1.0
   57    60   -62    50   0.09450 -1.0 2.0
   57    60   -62    50   0.11100  1.0 3.0
   57    60    62    67   0.56750  1.0 1.0
   57    60    62    67  -0.07550 -1.0 2.0
   57    60    62    67   0.20000  1.0 3.0
   57    60    62    70   0.56750  1.0 1.0
   57    60    62    70  -0.07550 -1.0 2.0
   57    60    62    70   0.20000  1.0 3.0
   57    60    63    64   0.15000  1.0 3.0
   57    60    63    65   0.15000  1.0 3.0
   57    60    63    66   0.15000  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   58    57    60    63   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   59    57    60    63   0.15000  1.0 3.0
   60    62    67    68   0.15000  1.0 3.0
   60    62    67    69   0.15000  1.0 3.0
   60    62    67    48   0.56750  1.0 1.0
   60    62    67    48  -0.07550 -1.0 2.0
   60    62    67    48   0.20000  1.0 3.0
   60    62    70    71   0.15000  1.0 3.0
   60    62    70    72   0.15000  1.0 3.0
   60    62    70    73   0.15000  1.0 3.0
   61    60    62    50   0.15000  1.0 3.0
   61    60    62    67   0.15000  1.0 3.0
   61    60    62    70   0.15000  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.15000  1.0 3.0
   62    50    51    52   0.34800  1.0 3.0
   62    50    51    53   0.34800  1.0 3.0
   62    50   -51    54   0.46850  1.0 1.0
   62    50   -51    54   0.08550 -1.0 2.0
   62    50   -51    54   0.09800  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    66   0.15000  1.0 3.0
   62    67    48    39   0.56750  1.0 1.0
   62    67    48    39  -0.07550 -1.0 2.0
   62    67    48    39   0.20000  1.0 3.0
   62    67   -48    44   0.56750  1.0 1.0
   62    67   -48    44  -0.07550 -1.0 2.0
   62    67   -48    44   0.20000  1.0 3.0
   62    67    48    49   0.15000  1.0 3.0
   67    62    70    71   0.15000  1.0 3.0
   67    62    70    72   0.15000  1.0 3.0
   67    62    70    73   0.15000  1.0 3.0
   68    67    48    39   0.15000  1.0 3.0
   68    67    48    44   0.15000  1.0 3.0
   68    67    48    49   0.15000  1.0 3.0
   69    67    48    39   0.15000  1.0 3.0
   69    67    48    44   0.15000  1.0 3.0
   69    67    48    49   0.15000  1.0 3.0
   48    39    41    42   0.30150 -1.0 2.0
   48    39   -41    43   0.36750  1.0 3.0
   48    44    46    47   0.00000  1.0 1.0
   48    44   -46    50   0.09850  1.0 1.0
   48    44   -46    50   0.15250 -1.0 2.0
   48    44   -46    50  -0.50650  1.0 3.0
   70    62    67    68   0.15000  1.0 3.0
   70    62    67    69   0.15000  1.0 3.0
   70    62    67    48   0.56750  1.0 1.0
   70    62    67    48  -0.07550 -1.0 2.0
   70    62    67    48   0.20000  1.0 3.0
   63    60    62    50   0.34400  1.0 1.0
   63    60    62    50   0.09450 -1.0 2.0
   63    60    62    50   0.11100  1.0 3.0
   63    60    62    67   0.56750  1.0 1.0
   63    60    62    67  -0.07550 -1.0 2.0
   63    60    62    67   0.20000  1.0 3.0
   63    60    62    70   0.56750  1.0 1.0
   63    60    62    70  -0.07550 -1.0 2.0
   63    60    62    70   0.20000  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
   38    30    36    37  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   44    47    46    50   1.10000 -1.0 2.0
   51    62    50    46   1.10000 -1.0 2.0
END
