* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    136    221     409
    1     0 S   NP   _N1_     1    29.08360    94.71014   -19.34248
    2     1 S   H    _HN1     2     1.02770    78.64157   -78.91691
    3     1 S   H    _H1_     3     1.02963    95.99955    28.66750
    4     1 S   H    _H2_     4     1.02829    37.03236   139.03887
    5     1 S   CT   _CA1     5     1.50173   145.10774   168.20766
    6     5 S   HC   _HA1     6     1.09567   105.19404    40.91053
    7     5 S   CO3  _C1_     7     1.53844   112.47943   -79.19524
    8     7 S   O2Z  _O11     8     1.26375   115.02618   -37.42580
    9     7 S   O2Z  _O12     9     1.26248   115.04313   141.70911
   10     5 S   CT   _CB1    10     1.53098   107.36923   158.93915
   11    10 S   HC   HB11    11     1.09819   109.44857   -48.53007
   12    10 S   HC   HB12    12     1.09809   110.29478    68.02716
   13    10 S   CT   _CG1    13     1.52971   112.73837  -169.59777
   14    13 S   HC   HG11    14     1.09535   110.42981   -61.64309
   15    13 S   HC   HG12    15     1.09641   110.06761    57.45361
   16    13 S   C    _CD1    16     1.51837   112.32830   177.63140
   17    16 S   O    _OE1    17     1.22711   123.30137    -9.42667
   18    16 S   N    _N2_    18     1.38595   111.56475   171.30771
   19    18 S   H    _HN2    19     1.01585   118.92449     1.28512
   20    18 S   CT1  _CA2    20     1.46227   123.55668  -178.69045
   21    20 S   HC   _HA2    21     1.09726   109.47638   -12.66655
   22    20 S   C    _C2_    22     1.53431   108.17935  -128.34680
   23    22 S   O    _O2_    23     1.23010   122.27339  -145.32301
   24    20 S   CT   _CB2    32     1.53491   111.13569   109.62302
   25    24 S   HC   HB21    33     1.09293   109.28387    54.67940
   26    24 S   HC   HB22    34     1.09519   110.55529   172.44643
   27    22 S   N    _N3_    24     1.38518   113.34485    42.00577
   28    27 S   H    _HN3    25     1.01531   118.90790    -0.58950
   29    24 S   S    _SG2    35     1.83229   111.41789   -69.22841
   30    27 S   CT   _CA3    26     1.45450   123.47012   175.21112
   31    30 S   HC   HA31    27     1.09521   109.27131    23.76605
   32    30 S   HC   HA32    28     1.09497   107.11386   140.76544
   33    29 S   CT   _C5_    36     1.89277   102.98301   136.95771
   34    30 S   CO3  _C3_    29     1.52919   113.08509   -99.74136
   35    34 S   O2Z  _O31    30     1.26403   115.38765   -45.10305
   36    34 S   O2Z  _O32    31     1.26352   114.99655   135.83217
   37    33 S   CT   _C6_    37     1.54358   106.88509    53.64388
   38    37 S   HC   _H11    38     1.10031   109.18671    38.00126
   39    37 S   HC   _H12    39     1.09790   110.54237   -76.56714
   40    33 S   CT   _C11    57     1.55293   108.54622   -68.90761
   41    40 S   HC   _H7_    58     1.09944   108.28221    44.25073
   42    33 S   CT   _C4_    69     1.54432   102.65108   170.11038
   43    42 S   HC   _H8_    70     1.09544   113.00875    54.52869
   44    42 S   HC   _H9_    71     1.09772   111.12325   -65.63639
   45    42 S   HC   _H10    72     1.09057   112.68127   174.92800
   46    37 S   CT   _C7_    40     1.53251   117.48821   158.98973
   47    46 S   HC   _H3_    41     1.09508   111.44275   -56.52827
   48    46 S   CT   _C8_    42     1.52572   113.79851    70.01273
   49    48 S   HC   _H4_    43     1.10065   108.72101    63.83156
   50    46 S   OH   _O37    67     1.43714   105.89686  -172.30928
   51    50 S   HO   _H19    68     0.97272   107.67328    64.65843
   52    48 S   CM   _C17    44     1.50147   116.68259  -176.79301
   53    52 S   CO4  _C16    45     1.47677   107.27780   156.52515
   54    53 S   O    _O36    46     1.21653   127.66286   165.53747
   55    52 S   CM   _C18    64     1.33597   132.13827   -20.91027
   56    55 S   HC   _H17    65     1.08355   121.79788    -1.45333
   57    55 S   HC   _H18    66     1.08567   121.51367   178.61280
   58    53 S   OS   _O35    47     1.36109   106.06907   -13.14851
   59    48 S   CT   _C9_    48     1.52645   116.43794   -60.69583
   60    59 S   HC   _H5_    49     1.09492   112.94010   -49.38577
   61    59 S   CT   _C10    50     1.53735   114.42691    78.28751
   62    61 S   HC   _H6_    51     1.09907   108.05421    47.79652
   63    61 S   CM   _C14    52     1.52628   113.13083   166.64335
   64    63 S   CM   _C13    53     1.33545   114.95327   114.44410
   65    64 S   HC   _H13    54     1.07640   128.64565   179.84805
   66    63 S   CT   _C15    59     1.49674   122.90192   -67.89742
   67    66 S   HC   _H14    60     1.09576   111.14643  -166.68632
   68    66 S   HC   _H15    61     1.09299   111.45319    73.33803
   69    64 S   CO4  _C12    55     1.46165   106.37045     4.11142
   70    69 S   O    _O33    56     1.22175   121.49778  -177.28668
   71    66 S   OH   _O34    62     1.42048   109.56952   -47.69876
   72    71 S   HO   _H16    63     0.97227   106.95276   179.68847
  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
  20   2   1   1  18   7   6  18   8   6   2   1   1  12   6  15
   8   3   1   9   8   3   4   1   1   5   7   3  10   4   9   7
   3   5   3   2   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    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46    61    69    40    41    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    48    59    61    62    63    64    69    70    40    41    50    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    48    49    52    59    61    69    40    41    50    51    42    43    44    45  
   39    46    47    48    40    50    42  
   46    47    48    40    50    42  
   41    66    42    43    44    45    46    48    58    59    60    61    62    63    64    65    69    70  
   42    59    61    62    63    64    69    70  
   43    44    45    46    61    69  
   44    45  
   45  
    0  
   47    48    49    52    53    58    59    60    61    55    50    51  
   48    49    52    59    50    51  
   49    52    53    54    58    59    60    61    62    63    55    56    57    50    51  
   52    53    58    59    60    61    55    50  
   51    52    59  
    0  
   53    54    58    59    60    61    55    56    57  
   54    58    59    60    61    55    56    57  
   58    59    55  
   56    57    58    59  
   57  
    0  
   59    60    61    62    63  
   60    61    62    63    64    69    66  
   61    62    63  
   62    63    64    65    69    70    66    67    68    71  
   63    64    69    66  
   64    65    69    70    66    67    68    71    72  
   65    69    70    66    67    68    71  
   69    70    66  
   67    68    71    72    69  
   68    71    72  
   71    72  
   70  
    0  
   72  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.4250   1.2500   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   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    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    40   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    46   268.000  1.529
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   320.000  1.410
   48    49   340.000  1.090
   48    52   317.000  1.510
   48    59   268.000  1.529
   52    53   320.000  1.462
   52    55   549.000  1.340
   53    54   570.000  1.229
   53    58   214.000  1.327
   58    59   320.000  1.410
   59    60   340.000  1.090
   59    61   268.000  1.529
   61    62   340.000  1.090
   61    63   317.000  1.510
   61    40   268.000  1.529
   63    64   549.000  1.340
   63    66   317.000  1.510
   64    65   340.000  1.080
   64    69   320.000  1.462
   69    70   570.000  1.229
   69    40   317.000  1.522
   40    41   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   320.000  1.410
   71    72   553.000  0.945
   55    56   340.000  1.080
   55    57   340.000  1.080
   50    51   553.000  0.945
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    46    58.35000  112.70000
   33    40    61    58.35000  112.70000
   33    40    69    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    37.50000  110.70000
   37    46    48    58.35000  112.70000
   37    46    50    50.00000  109.50000
   39    37    38    33.00000  107.80000
   46    37    38    37.50000  110.70000
   46    37    39    37.50000  110.70000
   46    48    49    37.50000  110.70000
   46    48    52    70.00000  112.02700
   46    48    59    58.35000  112.70000
   46    50    51    55.00000  108.50000
   48    46    47    37.50000  110.70000
   48    52    53    65.00000  116.34900
   48    52    55    70.00000  124.00000
   48    59    58    50.00000  109.50000
   48    59    60    37.50000  110.70000
   48    59    61    58.35000  112.70000
   52    48    49    35.00000  109.50000
   52    53    54    80.00000  123.72100
   52    53    58    90.00000  111.29400
   52    55    56    35.00000  120.00000
   52    55    57    35.00000  120.00000
   53    58    59    83.00000  116.90000
   58    53    54    83.00000  123.40000
   58    59    60    35.00000  109.50000
   58    59    61    50.00000  109.50000
   59    48    49    37.50000  110.70000
   59    48    52    70.00000  112.02700
   59    61    62    37.50000  110.70000
   59    61    63    70.00000  112.02700
   59    61    40    58.35000  112.70000
   61    59    60    37.50000  110.70000
   61    63    64    70.00000  124.00000
   61    63    66    65.00000  117.92700
   61    40    69    63.00000  111.10000
   61    40    41    37.50000  110.70000
   63    61    62    35.00000  109.50000
   63    64    65    35.00000  120.00000
   63    64    69    65.00000  118.96000
   63    66    67    35.00000  109.50000
   63    66    68    35.00000  109.50000
   63    66    71    90.00000  110.39200
   64    69    70    80.00000  123.72100
   64    69    40    65.00000  118.62400
   69    64    65    40.00000  117.72500
   69    40    41    35.00000  109.50000
   40    33    37    58.35000  112.70000
   40    61    62    37.50000  110.70000
   40    61    63    70.00000  112.02700
   40    69    70    80.00000  120.40000
   66    63    64    70.00000  124.00000
   66    71    72    55.00000  108.50000
   68    66    67    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    68    35.00000  109.50000
   55    52    53    65.00000  118.96000
   57    55    56    35.00000  117.00000
   50    46    47    35.00000  109.50000
   50    46    48    50.00000  109.50000
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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    39   0.15000  1.0 3.0
   29    33    37    46   0.44750  1.0 1.0
   29    33    37    46  -0.17800 -1.0 2.0
   29    33    37    46   0.20200  1.0 3.0
   29    33    40    61   0.44750  1.0 1.0
   29    33    40    61  -0.17800 -1.0 2.0
   29    33    40    61   0.20200  1.0 3.0
   29    33    40    69   0.56750  1.0 1.0
   29    33    40    69  -0.07550 -1.0 2.0
   29    33    40    69   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   0.15000  1.0 3.0
   33    37    46    48   0.56750  1.0 1.0
   33    37    46    48  -0.07550 -1.0 2.0
   33    37    46    48   0.20000  1.0 3.0
   33    37    46    50   0.86500  1.0 1.0
   33    37    46    50  -0.17500 -1.0 2.0
   33    37    46    50   0.20800  1.0 3.0
   37    33    40    61   0.56750  1.0 1.0
   37    33    40    61  -0.07550 -1.0 2.0
   37    33    40    61   0.20000  1.0 3.0
   37    33    40    69  -0.95700  1.0 1.0
   37    33    40    69  -0.18200 -1.0 2.0
   37    33    40    69   0.29450  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    45   0.15000  1.0 3.0
   37    46    48    49   0.15000  1.0 3.0
   37    46    48    52   0.34400  1.0 1.0
   37    46    48    52   0.09450 -1.0 2.0
   37    46    48    52   0.11100  1.0 3.0
   37    46    48    59   0.56750  1.0 1.0
   37    46    48    59  -0.07550 -1.0 2.0
   37    46    48    59   0.20000  1.0 3.0
   37    46    50    51  -0.11600  1.0 1.0
   37    46    50    51  -0.09450 -1.0 2.0
   37    46    50    51   0.21250  1.0 3.0
   38    37    46    47   0.15000  1.0 3.0
   38    37    46    48   0.15000  1.0 3.0
   38    37    46    50   0.23400  1.0 3.0
   39    37    46    47   0.15000  1.0 3.0
   39    37    46    48   0.15000  1.0 3.0
   39    37    46    50   0.23400  1.0 3.0
   46    48    52    53   0.09700  1.0 1.0
   46    48    52    53   0.15600 -1.0 2.0
   46    48    52    53  -0.50800  1.0 3.0
   46    48    52    55   0.09850  1.0 1.0
   46    48    52    55   0.15250 -1.0 2.0
   46    48    52    55  -0.50650  1.0 3.0
   46    48    59    58   0.62750  1.0 1.0
   46    48    59    58  -0.30950 -1.0 2.0
   46    48    59    58   0.27300  1.0 3.0
   46    48    59    60   0.15000  1.0 3.0
   46    48    59    61   0.56750  1.0 1.0
   46    48    59    61  -0.07550 -1.0 2.0
   46    48    59    61   0.20000  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    52   0.15000  1.0 3.0
   47    46    48    59   0.15000  1.0 3.0
   47    46    50    51   0.19450  1.0 3.0
   48    46    50    51  -0.11600  1.0 1.0
   48    46    50    51  -0.09450 -1.0 2.0
   48    46    50    51   0.21250  1.0 3.0
   48    52    53    54  -0.64400  1.0 1.0
   48    52    53    54   0.26850 -1.0 2.0
   48    52   -53    58  -0.15000  1.0 1.0
   48    52   -53    58   0.89550 -1.0 2.0
   48    52   -53    58  -0.06900  1.0 3.0
   48    52    55    56   7.00000 -1.0 2.0
   48    52    55    57   7.00000 -1.0 2.0
   48    59    61    62   0.15000  1.0 3.0
   48    59    61    63   0.34400  1.0 1.0
   48    59    61    63   0.09450 -1.0 2.0
   48    59    61    63   0.11100  1.0 3.0
   48    59    61    40   0.56750  1.0 1.0
   48    59    61    40  -0.07550 -1.0 2.0
   48    59    61    40   0.20000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    55   0.00000  1.0 1.0
   49    48    59    58   0.23400  1.0 3.0
   49    48    59    60   0.15000  1.0 3.0
   49    48    59    61   0.15000  1.0 3.0
   52    48   -59    58   0.61850  1.0 1.0
   52    48   -59    58  -0.22750 -1.0 2.0
   52    48   -59    58   0.15300  1.0 3.0
   52    48    59    60   0.15000  1.0 3.0
   52    48    59    61   0.34400  1.0 1.0
   52    48    59    61   0.09450 -1.0 2.0
   52    48    59    61   0.11100  1.0 3.0
   52    53   -58    59   2.00000 -1.0 2.0
   53    52    55    56   7.00000 -1.0 2.0
   53    52    55    57   7.00000 -1.0 2.0
   53    58   -59    48  -0.25900  1.0 1.0
   53    58   -59    48  -0.47000 -1.0 2.0
   53    58   -59    48   0.11750  1.0 3.0
   53    58    59    60   0.08050  1.0 3.0
   53    58    59    61  -0.25900  1.0 1.0
   53    58    59    61  -0.47000 -1.0 2.0
   53    58    59    61   0.11750  1.0 3.0
   54    53    58    59   3.00000 -1.0 2.0
   58    59    61    62   0.23400  1.0 3.0
   58    59    61    63   0.61850  1.0 1.0
   58    59    61    63  -0.22750 -1.0 2.0
   58    59    61    63   0.15300  1.0 3.0
   58    59    61    40   0.62750  1.0 1.0
   58    59    61    40  -0.30950 -1.0 2.0
   58    59    61    40   0.27300  1.0 3.0
   59    48   -52    53   0.09700  1.0 1.0
   59    48   -52    53   0.15600 -1.0 2.0
   59    48   -52    53  -0.50800  1.0 3.0
   59    48    52    55   0.09850  1.0 1.0
   59    48    52    55   0.15250 -1.0 2.0
   59    48    52    55  -0.50650  1.0 3.0
   59    61    63    64   0.09850  1.0 1.0
   59    61    63    64   0.15250 -1.0 2.0
   59    61    63    64  -0.50650  1.0 3.0
   59    61    63    66   0.46850  1.0 1.0
   59    61    63    66   0.08550 -1.0 2.0
   59    61    63    66   0.09800  1.0 3.0
   59    61    40    33   0.56750  1.0 1.0
   59    61    40    33  -0.07550 -1.0 2.0
   59    61    40    33   0.20000  1.0 3.0
   59    61    40    69  -0.95700  1.0 1.0
   59    61    40    69  -0.18200 -1.0 2.0
   59    61    40    69   0.29450  1.0 3.0
   59    61    40    41   0.15000  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    40   0.15000  1.0 3.0
   61    63    64    65   7.00000 -1.0 2.0
   61    63   -64    69   7.00000 -1.0 2.0
   61    63    66    67   0.34800  1.0 3.0
   61    63    66    68   0.34800  1.0 3.0
   61    63    66    71   0.18000  1.0 1.0
   61    63    66    71   0.16450 -1.0 2.0
   61    63    66    71   0.04450  1.0 3.0
   62    61    63    64   0.00000  1.0 1.0
   62    61    63    66   0.34800  1.0 3.0
   62    61    40    33   0.15000  1.0 3.0
   62    61    40    69  -0.11250  1.0 3.0
   62    61    40    41   0.15000  1.0 3.0
   63    61    40    33   0.34400  1.0 1.0
   63    61    40    33   0.09450 -1.0 2.0
   63    61    40    33   0.11100  1.0 3.0
   63    61   -40    69  -0.98800  1.0 1.0
   63    61   -40    69   0.48800 -1.0 2.0
   63    61   -40    69   0.76800  1.0 3.0
   63    61    40    41   0.15000  1.0 3.0
   63    64    69    70   1.00000 -1.0 2.0
   63    64   -69    40  -0.33500  1.0 1.0
   63    64   -69    40   1.06600 -1.0 2.0
   63    64   -69    40  -0.14000  1.0 3.0
   63    66    71    72  -0.07800  1.0 1.0
   63    66    71    72  -0.21500 -1.0 2.0
   63    66    71    72  -0.03150  1.0 3.0
   64    63    66    67   0.00000  1.0 1.0
   64    63    66    68   0.00000  1.0 1.0
   64    63    66    71   0.67800  1.0 1.0
   64    63    66    71   0.47050 -1.0 2.0
   64    63    66    71  -0.62500  1.0 3.0
   64    69    40    33   0.65300  1.0 1.0
   64    69    40    33  -0.03850 -1.0 2.0
   64    69    40    33   0.33900  1.0 3.0
   64    69   -40    61   0.65300  1.0 1.0
   64    69   -40    61  -0.03850 -1.0 2.0
   64    69   -40    61   0.33900  1.0 3.0
   64    69    40    41   0.00000  1.0 1.0
   65    64    69    70   0.00000  1.0 1.0
   65    64    69    40   0.04550  1.0 1.0
   65    64    69    40   0.83000 -1.0 2.0
   65    64    69    40  -0.04000  1.0 3.0
   70    69    40    33   0.30150 -1.0 2.0
   70    69    40    61   0.30150 -1.0 2.0
   70    69    40    41   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    46   0.56750  1.0 1.0
   40    33    37    46  -0.07550 -1.0 2.0
   40    33    37    46   0.20000  1.0 3.0
   40    33    42    43   0.15000  1.0 3.0
   40    33    42    44   0.15000  1.0 3.0
   40    33    42    45   0.15000  1.0 3.0
   40    61   -63    64   0.09850  1.0 1.0
   40    61   -63    64   0.15250 -1.0 2.0
   40    61   -63    64  -0.50650  1.0 3.0
   40    61    63    66   0.46850  1.0 1.0
   40    61    63    66   0.08550 -1.0 2.0
   40    61    63    66   0.09800  1.0 3.0
   66    63    64    65   7.00000 -1.0 2.0
   66    63    64    69   7.00000 -1.0 2.0
   67    66    71    72   0.19450  1.0 3.0
   68    66    71    72   0.19450  1.0 3.0
   55    52    53    54   1.00000 -1.0 2.0
   55    52    53    58  -0.56150  1.0 1.0
   55    52    53    58   2.19150 -1.0 2.0
   50    46    48    49   0.23400  1.0 3.0
   50    46    48    52   1.05650  1.0 1.0
   50    46    48    52   0.15600 -1.0 2.0
   50    46    48    52   0.53150  1.0 3.0
   50    46    48    59   0.86500  1.0 1.0
   50    46    48    59  -0.17500 -1.0 2.0
   50    46    48    59   0.20800  1.0 3.0
   42    33    37    38   0.15000  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    46   0.56750  1.0 1.0
   42    33    37    46  -0.07550 -1.0 2.0
   42    33    37    46   0.20000  1.0 3.0
   42    33    40    61   0.56750  1.0 1.0
   42    33    40    61  -0.07550 -1.0 2.0
   42    33    40    61   0.20000  1.0 3.0
   42    33    40    69  -0.95700  1.0 1.0
   42    33    40    69  -0.18200 -1.0 2.0
   42    33    40    69   0.29450  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
IPHI
    8     5     7     9  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
   35    30    34    36  10.50000 -1.0 2.0
   48    53    52    55   1.10000 -1.0 2.0
   52    58    53    54  10.50000 -1.0 2.0
   61    66    63    64   1.10000 -1.0 2.0
   69    65    64    63   1.10000 -1.0 2.0
   64    40    69    70  10.50000 -1.0 2.0
   56    57    55    52   1.10000 -1.0 2.0
END
