* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    135    218     404
    1     0 S   NP   _N1_     1    28.70909    95.21842   -23.87273
    2     1 S   H    _HN1     2     1.02780   105.45476   -82.59876
    3     1 S   H    _H1_     3     1.02953    78.21891    23.43110
    4     1 S   H    _H2_     4     1.02827    31.82309   178.22911
    5     1 S   CT   _CA1     5     1.50115   135.29945   130.59289
    6     5 S   HC   _HA1     6     1.09574   105.21075    83.81329
    7     5 S   CO3  _C1_     7     1.53800   112.44001   -36.41682
    8     7 S   O2Z  _O11     8     1.26370   115.00400   -42.65766
    9     7 S   O2Z  _O12     9     1.26243   114.94728   136.49504
   10     5 S   CT   _CB1    10     1.53087   107.41936  -158.21574
   11    10 S   HC   HB11    11     1.09829   109.38054   -49.98234
   12    10 S   HC   HB12    12     1.09816   110.43152    66.62302
   13    10 S   CT   _CG1    13     1.52978   112.60624  -171.00023
   14    13 S   HC   HG11    14     1.09592   110.54715   -64.72644
   15    13 S   HC   HG12    15     1.09667   109.86804    54.49698
   16    13 S   C    _CD1    16     1.51799   112.32198   174.92009
   17    16 S   O    _OE1    17     1.22720   123.32529     3.05889
   18    16 S   N    _N2_    18     1.38638   111.58584  -176.98325
   19    18 S   H    _HN2    19     1.01582   118.93085     1.87137
   20    18 S   CT1  _CA2    20     1.46221   123.44268   178.58294
   21    20 S   HC   _HA2    21     1.09736   109.42624    -0.97558
   22    20 S   C    _C2_    22     1.53484   108.47464  -116.49081
   23    22 S   O    _O2_    23     1.23047   122.32552  -147.52913
   24    20 S   CT   _CB2    32     1.53464   111.43550   121.11257
   25    24 S   HC   HB21    33     1.09401   109.46844    56.22239
   26    24 S   HC   HB22    34     1.09437   109.84691   175.14046
   27    22 S   N    _N3_    24     1.38347   113.61361    39.90433
   28    27 S   H    _HN3    25     1.01608   119.54740    -3.43974
   29    24 S   S    _SG2    35     1.82957   111.02683   -65.45701
   30    27 S   CT   _CA3    26     1.45286   123.16320   177.06135
   31    30 S   HC   HA31    27     1.09551   107.51518   -64.23762
   32    30 S   HC   HA32    28     1.09558   107.96659    52.18187
   33    29 S   CT   _C16    36     1.86801   102.32541   168.16212
   34    30 S   CO3  _C3_    29     1.52946   114.11813   174.17439
   35    34 S   O2Z  _O31    30     1.26370   116.06737    -0.75796
   36    34 S   O2Z  _O32    31     1.26430   114.40968   179.30255
   37    33 S   CT   _C11    37     1.55867   108.39372   -62.63183
   38    37 S   HC   _H26    38     1.09843   108.97660    86.85754
   39    37 S   HC   _H27    39     1.09845   110.50805   -27.84733
   40    33 S   CT   _C14    58     1.55222   108.79540   174.32425
   41    40 S   HC   _H30    59     1.10134   107.41399  -165.36270
   42    33 S   CT   _C17    68     1.54510   109.24911    55.49984
   43    42 S   HC   _H32    69     1.09420   112.62915    53.17574
   44    42 S   HC   _H33    70     1.09538   112.30583   -68.00028
   45    42 S   HC   _H34    71     1.09644   110.63306   173.40635
   46    37 S   CT   _C10    40     1.54186   117.27826  -151.76199
   47    46 S   HC   _H24    41     1.09730   106.92334  -157.76262
   48    46 S   HC   _H25    42     1.09552   111.51265   -41.86254
   49    46 S   CT   _C13    43     1.52842   111.11322    83.93226
   50    49 S   HC   _H29    44     1.10098   108.35594    43.53022
   51    49 S   CM   _C6_    45     1.49026   120.35050   164.41034
   52    51 S   CO4  _C8_    46     1.48597   106.13603   159.00239
   53    52 S   O    _O17    47     1.21661   127.40745   164.80100
   54    51 S   CM   _C9_    65     1.33427   131.38893   -19.45902
   55    54 S   HC   _H22    66     1.08417   121.36400    -1.01722
   56    54 S   HC   _H23    67     1.08538   121.42280   179.12777
   57    52 S   OS   _O18    48     1.37120   106.27644   -13.59893
   58    49 S   CT   _C15    49     1.52311   115.07938   -79.29673
   59    58 S   HC   _H31    50     1.10098   111.91258   -57.73047
   60    58 S   CT   _C12    51     1.53614   111.87860    65.37809
   61    60 S   HC   _H28    52     1.09738   109.67050    46.56020
   62    60 S   CM   _C5_    53     1.51612   116.55169   168.23211
   63    62 S   CM   _C4_    54     1.33725   114.59484   128.63492
   64    63 S   HC   _H21    55     1.07641   128.60766   176.71646
   65    62 S   CT   _C18    60     1.49430   122.32854   -56.37601
   66    65 S   HC   _H35    61     1.09544   111.40097  -169.98873
   67    65 S   HC   _H36    62     1.09363   110.94200    69.96635
   68    63 S   CO4  _C7_    56     1.46614   106.67675    -2.03144
   69    68 S   O    _O16    57     1.22143   122.10132   176.21142
   70    65 S   OH   _O19    63     1.41997   109.37481   -50.72982
   71    70 S   HO   _H37    64     0.97221   107.09176   177.04885
  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  17   7   6  18   8   6   2   1   1  11   5   4
  13   7   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    60    68    40    41    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    48    49    58    60    61    62    63    68    69    40    41    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    48    49    50    51    58    60    68    40    41    42    43    44    45  
   39    46    47    48    49    40    42  
   46    47    48    49    40    42  
   41    65    42    43    44    45    46    49    57    58    59    60    61    62    63    64    68    69  
   42    58    60    61    62    63    68    69  
   43    44    45    46    60    68  
   44    45  
   45  
    0  
   47    48    49    50    51    52    57    58    59    60    54  
   48    49    50    51    58  
   49    50    51    58  
   50    51    52    53    57    58    59    60    61    62    54    55    56  
   51    52    57    58    59    60    54  
   52    53    57    58    59    60    54    55    56  
   53    57    58    59    60    54    55    56  
   57    58    54  
   55    56    57    58  
   56  
    0  
   58    59    60    61    62  
   59    60    61    62    63    68    65  
   60    61    62  
   61    62    63    64    68    69    65    66    67    70  
   62    63    68    65  
   63    64    68    69    65    66    67    70    71  
   64    68    69    65    66    67    70  
   68    69    65  
   66    67    70    71    68  
   67    70    71  
   70    71  
   69  
    0  
   71  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   58   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   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   340.000  1.090
   46    49   268.000  1.529
   49    50   340.000  1.090
   49    51   317.000  1.510
   49    58   268.000  1.529
   51    52   320.000  1.462
   51    54   549.000  1.340
   52    53   570.000  1.229
   52    57   214.000  1.327
   57    58   320.000  1.410
   58    59   340.000  1.090
   58    60   268.000  1.529
   60    61   340.000  1.090
   60    62   317.000  1.510
   60    40   268.000  1.529
   62    63   549.000  1.340
   62    65   317.000  1.510
   63    64   340.000  1.080
   63    68   320.000  1.462
   68    69   570.000  1.229
   68    40   317.000  1.522
   40    41   340.000  1.090
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    70   320.000  1.410
   70    71   553.000  0.945
   54    55   340.000  1.080
   54    56   340.000  1.080
   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    60    58.35000  112.70000
   33    40    68    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    37.50000  110.70000
   37    46    49    58.35000  112.70000
   39    37    38    33.00000  107.80000
   46    37    38    37.50000  110.70000
   46    37    39    37.50000  110.70000
   46    49    50    37.50000  110.70000
   46    49    51    70.00000  112.02700
   46    49    58    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    37.50000  110.70000
   49    46    48    37.50000  110.70000
   49    51    52    65.00000  116.34900
   49    51    54    70.00000  124.00000
   49    58    57    50.00000  109.50000
   49    58    59    37.50000  110.70000
   49    58    60    58.35000  112.70000
   51    49    50    35.00000  109.50000
   51    52    53    80.00000  123.72100
   51    52    57    90.00000  111.29400
   51    54    55    35.00000  120.00000
   51    54    56    35.00000  120.00000
   52    57    58    83.00000  116.90000
   57    52    53    83.00000  123.40000
   57    58    59    35.00000  109.50000
   57    58    60    50.00000  109.50000
   58    49    50    37.50000  110.70000
   58    49    51    70.00000  112.02700
   58    60    61    37.50000  110.70000
   58    60    62    70.00000  112.02700
   58    60    40    58.35000  112.70000
   60    58    59    37.50000  110.70000
   60    62    63    70.00000  124.00000
   60    62    65    65.00000  117.92700
   60    40    68    63.00000  111.10000
   60    40    41    37.50000  110.70000
   62    60    61    35.00000  109.50000
   62    63    64    35.00000  120.00000
   62    63    68    65.00000  118.96000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    70    90.00000  110.39200
   63    68    69    80.00000  123.72100
   63    68    40    65.00000  118.62400
   68    63    64    40.00000  117.72500
   68    40    41    35.00000  109.50000
   40    33    37    58.35000  112.70000
   40    60    61    37.50000  110.70000
   40    60    62    70.00000  112.02700
   40    68    69    80.00000  120.40000
   65    62    63    70.00000  124.00000
   65    70    71    55.00000  108.50000
   67    65    66    33.00000  107.80000
   70    65    66    35.00000  109.50000
   70    65    67    35.00000  109.50000
   54    51    52    65.00000  118.96000
   56    54    55    35.00000  117.00000
   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    60   0.44750  1.0 1.0
   29    33    40    60  -0.17800 -1.0 2.0
   29    33    40    60   0.20200  1.0 3.0
   29    33    40    68   0.56750  1.0 1.0
   29    33    40    68  -0.07550 -1.0 2.0
   29    33    40    68   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   0.15000  1.0 3.0
   33    37    46    49   0.56750  1.0 1.0
   33    37    46    49  -0.07550 -1.0 2.0
   33    37    46    49   0.20000  1.0 3.0
   37    33    40    60   0.56750  1.0 1.0
   37    33    40    60  -0.07550 -1.0 2.0
   37    33    40    60   0.20000  1.0 3.0
   37    33    40    68  -0.95700  1.0 1.0
   37    33    40    68  -0.18200 -1.0 2.0
   37    33    40    68   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    49    50   0.15000  1.0 3.0
   37    46    49    51   0.34400  1.0 1.0
   37    46    49    51   0.09450 -1.0 2.0
   37    46    49    51   0.11100  1.0 3.0
   37    46    49    58   0.56750  1.0 1.0
   37    46    49    58  -0.07550 -1.0 2.0
   37    46    49    58   0.20000  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    49   0.15000  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    49   0.15000  1.0 3.0
   46    49    51    52   0.09700  1.0 1.0
   46    49    51    52   0.15600 -1.0 2.0
   46    49    51    52  -0.50800  1.0 3.0
   46    49    51    54   0.09850  1.0 1.0
   46    49    51    54   0.15250 -1.0 2.0
   46    49    51    54  -0.50650  1.0 3.0
   46    49    58    57   0.62750  1.0 1.0
   46    49    58    57  -0.30950 -1.0 2.0
   46    49    58    57   0.27300  1.0 3.0
   46    49    58    59   0.15000  1.0 3.0
   46    49    58    60   0.56750  1.0 1.0
   46    49    58    60  -0.07550 -1.0 2.0
   46    49    58    60   0.20000  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    58   0.15000  1.0 3.0
   48    46    49    50   0.15000  1.0 3.0
   48    46    49    51   0.15000  1.0 3.0
   48    46    49    58   0.15000  1.0 3.0
   49    51    52    53  -0.64400  1.0 1.0
   49    51    52    53   0.26850 -1.0 2.0
   49    51   -52    57  -0.15000  1.0 1.0
   49    51   -52    57   0.89550 -1.0 2.0
   49    51   -52    57  -0.06900  1.0 3.0
   49    51    54    55   7.00000 -1.0 2.0
   49    51    54    56   7.00000 -1.0 2.0
   49    58    60    61   0.15000  1.0 3.0
   49    58    60    62   0.34400  1.0 1.0
   49    58    60    62   0.09450 -1.0 2.0
   49    58    60    62   0.11100  1.0 3.0
   49    58    60    40   0.56750  1.0 1.0
   49    58    60    40  -0.07550 -1.0 2.0
   49    58    60    40   0.20000  1.0 3.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    54   0.00000  1.0 1.0
   50    49    58    57   0.23400  1.0 3.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    60   0.15000  1.0 3.0
   51    49   -58    57   0.61850  1.0 1.0
   51    49   -58    57  -0.22750 -1.0 2.0
   51    49   -58    57   0.15300  1.0 3.0
   51    49    58    59   0.15000  1.0 3.0
   51    49    58    60   0.34400  1.0 1.0
   51    49    58    60   0.09450 -1.0 2.0
   51    49    58    60   0.11100  1.0 3.0
   51    52   -57    58   2.00000 -1.0 2.0
   52    51    54    55   7.00000 -1.0 2.0
   52    51    54    56   7.00000 -1.0 2.0
   52    57   -58    49  -0.25900  1.0 1.0
   52    57   -58    49  -0.47000 -1.0 2.0
   52    57   -58    49   0.11750  1.0 3.0
   52    57    58    59   0.08050  1.0 3.0
   52    57    58    60  -0.25900  1.0 1.0
   52    57    58    60  -0.47000 -1.0 2.0
   52    57    58    60   0.11750  1.0 3.0
   53    52    57    58   3.00000 -1.0 2.0
   57    58    60    61   0.23400  1.0 3.0
   57    58    60    62   0.61850  1.0 1.0
   57    58    60    62  -0.22750 -1.0 2.0
   57    58    60    62   0.15300  1.0 3.0
   57    58    60    40   0.62750  1.0 1.0
   57    58    60    40  -0.30950 -1.0 2.0
   57    58    60    40   0.27300  1.0 3.0
   58    49   -51    52   0.09700  1.0 1.0
   58    49   -51    52   0.15600 -1.0 2.0
   58    49   -51    52  -0.50800  1.0 3.0
   58    49    51    54   0.09850  1.0 1.0
   58    49    51    54   0.15250 -1.0 2.0
   58    49    51    54  -0.50650  1.0 3.0
   58    60    62    63   0.09850  1.0 1.0
   58    60    62    63   0.15250 -1.0 2.0
   58    60    62    63  -0.50650  1.0 3.0
   58    60    62    65   0.46850  1.0 1.0
   58    60    62    65   0.08550 -1.0 2.0
   58    60    62    65   0.09800  1.0 3.0
   58    60    40    33   0.56750  1.0 1.0
   58    60    40    33  -0.07550 -1.0 2.0
   58    60    40    33   0.20000  1.0 3.0
   58    60    40    68  -0.95700  1.0 1.0
   58    60    40    68  -0.18200 -1.0 2.0
   58    60    40    68   0.29450  1.0 3.0
   58    60    40    41   0.15000  1.0 3.0
   59    58    60    61   0.15000  1.0 3.0
   59    58    60    62   0.15000  1.0 3.0
   59    58    60    40   0.15000  1.0 3.0
   60    62    63    64   7.00000 -1.0 2.0
   60    62   -63    68   7.00000 -1.0 2.0
   60    62    65    66   0.34800  1.0 3.0
   60    62    65    67   0.34800  1.0 3.0
   60    62    65    70   0.18000  1.0 1.0
   60    62    65    70   0.16450 -1.0 2.0
   60    62    65    70   0.04450  1.0 3.0
   61    60    62    63   0.00000  1.0 1.0
   61    60    62    65   0.34800  1.0 3.0
   61    60    40    33   0.15000  1.0 3.0
   61    60    40    68  -0.11250  1.0 3.0
   61    60    40    41   0.15000  1.0 3.0
   62    60    40    33   0.34400  1.0 1.0
   62    60    40    33   0.09450 -1.0 2.0
   62    60    40    33   0.11100  1.0 3.0
   62    60   -40    68  -0.98800  1.0 1.0
   62    60   -40    68   0.48800 -1.0 2.0
   62    60   -40    68   0.76800  1.0 3.0
   62    60    40    41   0.15000  1.0 3.0
   62    63    68    69   1.00000 -1.0 2.0
   62    63   -68    40  -0.33500  1.0 1.0
   62    63   -68    40   1.06600 -1.0 2.0
   62    63   -68    40  -0.14000  1.0 3.0
   62    65    70    71  -0.07800  1.0 1.0
   62    65    70    71  -0.21500 -1.0 2.0
   62    65    70    71  -0.03150  1.0 3.0
   63    62    65    66   0.00000  1.0 1.0
   63    62    65    67   0.00000  1.0 1.0
   63    62    65    70   0.67800  1.0 1.0
   63    62    65    70   0.47050 -1.0 2.0
   63    62    65    70  -0.62500  1.0 3.0
   63    68    40    33   0.65300  1.0 1.0
   63    68    40    33  -0.03850 -1.0 2.0
   63    68    40    33   0.33900  1.0 3.0
   63    68   -40    60   0.65300  1.0 1.0
   63    68   -40    60  -0.03850 -1.0 2.0
   63    68   -40    60   0.33900  1.0 3.0
   63    68    40    41   0.00000  1.0 1.0
   64    63    68    69   0.00000  1.0 1.0
   64    63    68    40   0.04550  1.0 1.0
   64    63    68    40   0.83000 -1.0 2.0
   64    63    68    40  -0.04000  1.0 3.0
   69    68    40    33   0.30150 -1.0 2.0
   69    68    40    60   0.30150 -1.0 2.0
   69    68    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    60   -62    63   0.09850  1.0 1.0
   40    60   -62    63   0.15250 -1.0 2.0
   40    60   -62    63  -0.50650  1.0 3.0
   40    60    62    65   0.46850  1.0 1.0
   40    60    62    65   0.08550 -1.0 2.0
   40    60    62    65   0.09800  1.0 3.0
   65    62    63    64   7.00000 -1.0 2.0
   65    62    63    68   7.00000 -1.0 2.0
   66    65    70    71   0.19450  1.0 3.0
   67    65    70    71   0.19450  1.0 3.0
   54    51    52    53   1.00000 -1.0 2.0
   54    51    52    57  -0.56150  1.0 1.0
   54    51    52    57   2.19150 -1.0 2.0
   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    60   0.56750  1.0 1.0
   42    33    40    60  -0.07550 -1.0 2.0
   42    33    40    60   0.20000  1.0 3.0
   42    33    40    68  -0.95700  1.0 1.0
   42    33    40    68  -0.18200 -1.0 2.0
   42    33    40    68   0.29450  1.0 3.0
   42    33    40    41   0.15000  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    52    51    54   1.10000 -1.0 2.0
   51    57    52    53  10.50000 -1.0 2.0
   60    65    62    63   1.10000 -1.0 2.0
   68    64    63    62   1.10000 -1.0 2.0
   63    40    68    69  10.50000 -1.0 2.0
   55    56    54    51   1.10000 -1.0 2.0
END
