* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    128    196     379
    1     0 S   NP   _N1_     1    29.46827    92.91324   -23.65976
    2     1 S   H    _HN1     2     1.02776   105.92807   -86.18285
    3     1 S   H    _H1_     3     1.02963    90.25103    23.00059
    4     1 S   H    _H2_     4     1.02839    19.05323   175.04322
    5     1 S   CT   _CA1     5     1.50127   126.74157   138.97020
    6     5 S   HC   _HA1     6     1.09575   105.21846    70.94608
    7     5 S   CO3  _C1_     7     1.53779   112.43005   -49.22923
    8     7 S   O2Z  _O11     8     1.26357   114.99470   -42.36367
    9     7 S   O2Z  _O12     9     1.26237   114.92321   136.81403
   10     5 S   CT   _CB1    10     1.53098   107.43706  -171.13853
   11    10 S   HC   HB11    11     1.09826   109.29248   -50.76163
   12    10 S   HC   HB12    12     1.09819   110.41490    65.77306
   13    10 S   CT   _CG1    13     1.53024   112.71569  -171.88091
   14    13 S   HC   HG11    14     1.09593   110.44393   -64.51578
   15    13 S   HC   HG12    15     1.09653   109.98013    54.72523
   16    13 S   C    _CD1    16     1.51805   112.32275   175.04382
   17    16 S   O    _OE1    17     1.22721   123.25076    -1.80808
   18    16 S   N    _N2_    18     1.38640   111.66845   178.52249
   19    18 S   H    _HN2    19     1.01576   119.05807     1.62389
   20    18 S   CT1  _CA2    20     1.46111   123.35509   179.83807
   21    20 S   HC   _HA2    21     1.09508   109.31397    -1.57719
   22    20 S   C    _C2_    22     1.53457   108.29555  -116.79958
   23    22 S   O    _O2_    23     1.23028   122.27720  -143.40313
   24    20 S   CT   _CB2    32     1.53410   111.74705   121.00546
   25    24 S   HC   HB21    33     1.09675   109.43646    64.00861
   26    24 S   HC   HB22    34     1.09503   110.76204  -179.20083
   27    22 S   N    _N3_    24     1.38532   113.53341    43.58324
   28    27 S   H    _HN3    25     1.01469   119.03077     0.65072
   29    24 S   S    _SG2    35     1.83041   114.98127   -55.25367
   30    27 S   CT   _CA3    26     1.45402   123.11516   176.98383
   31    30 S   HC   HA31    27     1.09560   108.65815    32.37414
   32    30 S   HC   HA32    28     1.09485   107.11330   149.25199
   33    29 S   CT   _C6_    36     1.82534   100.61154   -65.65511
   34    33 S   HC   _H3_    37     1.09277   109.64817    55.63184
   35    30 S   CO3  _C3_    29     1.52862   114.18448   -90.61725
   36    35 S   O2Z  _O31    30     1.26376   116.06345   -29.12119
   37    35 S   O2Z  _O32    31     1.26410   114.66205   151.69546
   38    33 S   CM   _C4_    38     1.48210   109.03696   176.28437
   39    38 S   HC   _H21    39     1.08329   122.88604   -67.97317
   40    38 S   CMA  _C5_    40     1.34263   112.92759   112.62527
   41    40 S   OM   _O33    41     1.26152   127.05206  -179.98022
   42    40 S   OS   _O13    42     1.41748   109.79374    -0.72199
   43    33 S   CT   _C10    43     1.52852   113.93100   -72.51117
   44    43 S   HC   _H26    44     1.09633   112.32357    14.64013
   45    43 S   CT   _C13    45     1.53053   112.17364   137.02234
   46    45 S   HC   _H29    46     1.09656   109.97376   171.15589
   47    45 S   HC   _H30    47     1.09716   110.44536    52.85222
   48    45 S   OS1  _O19    48     1.42546   108.79752   -69.27592
   49    48 S   CO1  _C12    49     1.43200   112.35255   169.00977
   50    49 S   HC   _H28    50     1.09858   108.68940    45.61568
   51    49 S   CT   _C9_    51     1.53302   107.59176   164.98579
   52    51 S   HC   _H25    52     1.09582   110.03296    52.01031
   53    51 S   CT   _C7_    53     1.53095   111.02108   174.18405
   54    53 S   HC   _H23    54     1.09674   110.10845    73.06907
   55    51 S   OH5  _O17    69     1.42998   109.74551   -64.65446
   56    55 S   HO   _H35    70     0.97192   108.20467   -62.95188
   57    53 S   CT   _C8_    55     1.53168   111.36640   -49.37931
   58    57 S   HC   _H24    56     1.09661   109.24555   -71.31915
   59    53 S   OH5  _O15    67     1.42804   109.86520  -171.12365
   60    59 S   HO   _H33    68     0.97633   108.02418    61.42196
   61    57 S   CT   _C11    57     1.53224   110.61981    50.03428
   62    61 S   HC   _H27    58     1.09833   110.89751    64.51767
   63    57 S   OH5  _O16    65     1.42690   109.72677   171.66360
   64    63 S   HO   _H34    66     0.97228   108.18892   -55.76359
   65    49 S   OS1  _O14    59     1.42792   110.07448   -75.11355
   66    61 S   CT   _C14    60     1.52986   111.46759  -174.68522
   67    66 S   HC   _H31    61     1.09513   110.97626    70.24188
   68    66 S   HC   _H32    62     1.09392   111.63143   -52.19848
   69    66 S   OH5  _O18    63     1.42520   109.02803  -171.09808
   70    69 S   HO   _H36    64     0.97235   107.00329  -176.42560
  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   9   5   4   3
  12   7   2   1   1   7   4   5   2   6   6   4   7   3   2   8
  13   6  12   7  13   7   4   1  12   7   3   1   9   6   3   1
   4   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    43    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    43    44    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48  
   38    39    40    42    43    44    45  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45  
   40    41    42    43  
   41    42    43    44    45  
   42    43  
   43    44    45    46    47    48  
   44    45    46    47    48    49  
   45    46    47    48  
   46    47    48    49    50    51    65  
   47    48    49  
   48    49  
   49    50    51    52    53    61    65    55  
   50    51    52    53    54    57    61    62    65    66    59    55    56  
   51    52    53    61    65    55  
   52    53    54    57    58    61    65    63    59    60    55    56  
   53    54    57    65    59    55    56  
   54    57    58    61    62    65    66    63    64    59    60    55    56  
   57    58    61    63    59    60    55  
   56    57    59    65  
    0  
   58    61    62    65    66    67    68    69    63    64    59    60  
   61    62    65    66    63    64    59  
   60    61    63  
    0  
   62    65    66    67    68    69    70    63    64  
   65    66    67    68    69    63  
   64    65    66  
    0  
   66    67    68    69  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    43   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   335.000  1.422
   48    49   370.000  1.399
   49    50   360.000  1.097
   49    51   255.000  1.525
   49    65   370.000  1.399
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   355.000  1.421
   53    54   340.000  1.090
   53    57   268.000  1.529
   53    59   355.000  1.421
   57    58   340.000  1.090
   57    61   268.000  1.529
   57    63   355.000  1.421
   61    62   340.000  1.090
   61    65   335.000  1.422
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   355.000  1.421
   69    70   580.000  0.967
   63    64   580.000  0.967
   59    60   580.000  0.967
   55    56   580.000  0.967
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    43    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    43    42    50.00000  109.50000
   33    43    44    37.50000  110.70000
   33    43    45    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    80.00000  120.01400
   40    38    39    40.00000  120.50800
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   43    33    34    37.50000  110.70000
   43    33    38    70.00000  112.02700
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    48    95.00000  107.88500
   45    43    44    37.50000  110.70000
   45    48    49    90.00000  112.10700
   47    45    46    33.00000  107.80000
   48    45    46    55.00000  108.98800
   48    45    47    55.00000  108.98800
   48    49    50    60.00000  105.75400
   48    49    51    90.00000  109.70700
   48    49    65   110.00000  113.16000
   49    51    52    45.00000  109.54000
   49    51    53    70.00000  111.10000
   49    51    55    90.00000  109.42000
   49    65    61    90.00000  112.10700
   51    49    50    45.00000  111.65000
   51    53    54    37.50000  110.70000
   51    53    57    58.35000  112.70000
   51    53    59    90.00000  111.45300
   51    55    56    65.00000  108.53500
   53    51    52    37.50000  110.70000
   53    57    58    37.50000  110.70000
   53    57    61    58.35000  112.70000
   53    57    63    90.00000  111.45300
   53    59    60    65.00000  108.53500
   57    53    54    37.50000  110.70000
   57    61    62    37.50000  110.70000
   57    61    65    95.00000  107.88500
   57    61    66    58.35000  112.70000
   57    63    64    65.00000  108.53500
   61    57    58    37.50000  110.70000
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    69    90.00000  111.45300
   65    49    50    60.00000  105.75400
   65    49    51    90.00000  109.70700
   65    61    62    55.00000  108.98800
   66    61    62    37.50000  110.70000
   66    61    65    95.00000  107.88500
   66    69    70    65.00000  108.53500
   68    66    67    33.00000  107.80000
   69    66    67    60.00000  109.39000
   69    66    68    60.00000  109.39000
   63    57    58    60.00000  109.39000
   63    57    61    90.00000  111.45300
   59    53    54    60.00000  109.39000
   59    53    57    90.00000  111.45300
   55    51    52    60.00000  109.39000
   55    51    53    90.00000  111.45300
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    43   0.01700  1.0 1.0
   24    29    33    43  -0.23550 -1.0 2.0
   24    29    33    43   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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    43    42   0.56750  1.0 1.0
   29    33    43    42  -0.07550 -1.0 2.0
   29    33    43    42   0.20000  1.0 3.0
   29    33    43    44   0.15000  1.0 3.0
   29    33    43    45   0.44750  1.0 1.0
   29    33    43    45  -0.17800 -1.0 2.0
   29    33    43    45   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38   -40    42   7.00000 -1.0 2.0
   33    43    45    46   0.15000  1.0 3.0
   33    43    45    47   0.15000  1.0 3.0
   33    43    45    48   0.62750  1.0 1.0
   33    43    45    48  -0.30950 -1.0 2.0
   33    43    45    48   0.27300  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    43    42   0.23400  1.0 3.0
   34    33    43    44   0.15000  1.0 3.0
   34    33    43    45   0.15000  1.0 3.0
   38    33   -43    42   0.61850  1.0 1.0
   38    33   -43    42  -0.22750 -1.0 2.0
   38    33   -43    42   0.15300  1.0 3.0
   38    33    43    44   0.15000  1.0 3.0
   38    33    43    45   0.34400  1.0 1.0
   38    33    43    45   0.09450 -1.0 2.0
   38    33    43    45   0.11100  1.0 3.0
   38    40   -42    43  -2.26850  1.0 1.0
   38    40   -42    43   3.39050 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42   -43    33  -0.46850  1.0 1.0
   40    42   -43    33   0.09300 -1.0 2.0
   40    42   -43    33  -0.12850  1.0 3.0
   40    42    43    44   0.08050  1.0 3.0
   40    42    43    45  -0.46850  1.0 1.0
   40    42    43    45   0.09300 -1.0 2.0
   40    42    43    45  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    47   0.23400  1.0 3.0
   42    43    45    48   1.11900  1.0 1.0
   42    43    45    48  -1.16350 -1.0 2.0
   42    43    45    48  -0.34150  1.0 3.0
   43    33    38    39   0.00000  1.0 1.0
   43    33   -38    40   0.09850  1.0 1.0
   43    33   -38    40   0.15250 -1.0 2.0
   43    33   -38    40  -0.50650  1.0 3.0
   43    45    48    49   0.06250  1.0 1.0
   43    45    48    49  -0.01100 -1.0 2.0
   43    45    48    49   0.28050  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    48   0.23400  1.0 3.0
   45    48    49    50   0.37050  1.0 3.0
   45    48    49    51   0.06250  1.0 1.0
   45    48    49    51  -0.01100 -1.0 2.0
   45    48    49    51   0.28050  1.0 3.0
   45    48    49    65  -0.12700  1.0 1.0
   45    48    49    65  -1.16200 -1.0 2.0
   45    48    49    65   0.58800  1.0 3.0
   46    45    48    49   0.37050  1.0 3.0
   47    45    48    49   0.37050  1.0 3.0
   48    49    51    52   0.23400  1.0 3.0
   48    49    51    53   0.62750  1.0 1.0
   48    49    51    53  -0.30950 -1.0 2.0
   48    49    51    53   0.27300  1.0 3.0
   48    49    51    55   1.51850  1.0 1.0
   48    49    65    61  -0.70400  1.0 1.0
   48    49    65    61  -0.90350 -1.0 2.0
   49    51    53    54   0.15000  1.0 3.0
   49    51    53    57   0.56750  1.0 1.0
   49    51    53    57  -0.07550 -1.0 2.0
   49    51    53    57   0.20000  1.0 3.0
   49    51    53    59  -0.47750  1.0 1.0
   49    51    55    56   0.29150  1.0 1.0
   49    51    55    56  -0.28350 -1.0 2.0
   49    51    55    56   0.43600  1.0 3.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    53   0.15000  1.0 3.0
   50    49    51    55   0.23400  1.0 3.0
   50    49    65    61   0.37050  1.0 3.0
   51    49    65    61   0.06250  1.0 1.0
   51    49    65    61  -0.01100 -1.0 2.0
   51    49    65    61   0.28050  1.0 3.0
   51    53    57    58   0.15000  1.0 3.0
   51    53   -57    61   0.56750  1.0 1.0
   51    53   -57    61  -0.07550 -1.0 2.0
   51    53   -57    61   0.20000  1.0 3.0
   51    53    57    63  -0.47750  1.0 1.0
   51    53    59    60   0.29150  1.0 1.0
   51    53    59    60  -0.28350 -1.0 2.0
   51    53    59    60   0.43600  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    57   0.15000  1.0 3.0
   52    51    53    59   0.23400  1.0 3.0
   52    51    55    56   0.19450  1.0 3.0
   53    51    55    56   0.29150  1.0 1.0
   53    51    55    56  -0.28350 -1.0 2.0
   53    51    55    56   0.43600  1.0 3.0
   53    57    61    62   0.15000  1.0 3.0
   53    57    61    65   0.62750  1.0 1.0
   53    57    61    65  -0.30950 -1.0 2.0
   53    57    61    65   0.27300  1.0 3.0
   53    57    61    66   0.56750  1.0 1.0
   53    57    61    66  -0.07550 -1.0 2.0
   53    57    61    66   0.20000  1.0 3.0
   53    57    63    64   0.29150  1.0 1.0
   53    57    63    64  -0.28350 -1.0 2.0
   53    57    63    64   0.43600  1.0 3.0
   54    53    57    58   0.15000  1.0 3.0
   54    53    57    61   0.15000  1.0 3.0
   54    53    57    63   0.23400  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   57    53    59    60   0.29150  1.0 1.0
   57    53    59    60  -0.28350 -1.0 2.0
   57    53    59    60   0.43600  1.0 3.0
   57    61   -65    49   0.06250  1.0 1.0
   57    61   -65    49  -0.01100 -1.0 2.0
   57    61   -65    49   0.28050  1.0 3.0
   57    61    66    67   0.15000  1.0 3.0
   57    61    66    68   0.15000  1.0 3.0
   57    61    66    69  -0.47750  1.0 1.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    65   0.23400  1.0 3.0
   58    57    61    66   0.15000  1.0 3.0
   58    57    63    64   0.19450  1.0 3.0
   61    57    63    64   0.29150  1.0 1.0
   61    57    63    64  -0.28350 -1.0 2.0
   61    57    63    64   0.43600  1.0 3.0
   61    66    69    70   0.29150  1.0 1.0
   61    66    69    70  -0.28350 -1.0 2.0
   61    66    69    70   0.43600  1.0 3.0
   62    61    65    49   0.37050  1.0 3.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    68   0.15000  1.0 3.0
   62    61    66    69   0.23400  1.0 3.0
   65    49    51    52   0.23400  1.0 3.0
   65    49   -51    53   0.62750  1.0 1.0
   65    49   -51    53  -0.30950 -1.0 2.0
   65    49   -51    53   0.27300  1.0 3.0
   65    49    51    55   1.51850  1.0 1.0
   65    61    66    67   0.23400  1.0 3.0
   65    61    66    68   0.23400  1.0 3.0
   65    61    66    69   1.51850  1.0 1.0
   66    61    65    49   0.06250  1.0 1.0
   66    61    65    49  -0.01100 -1.0 2.0
   66    61    65    49   0.28050  1.0 3.0
   67    66    69    70   0.19450  1.0 3.0
   68    66    69    70   0.19450  1.0 3.0
   63    57    61    62   0.23400  1.0 3.0
   63    57    61    65   1.51850  1.0 1.0
   63    57    61    66  -0.47750  1.0 1.0
   59    53    57    58   0.23400  1.0 3.0
   59    53    57    61  -0.47750  1.0 1.0
   59    53    57    63   3.77950  1.0 1.0
   55    51    53    54   0.23400  1.0 3.0
   55    51    53    57  -0.47750  1.0 1.0
   55    51    53    59   3.77950  1.0 1.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   41    42    40    38   1.10000 -1.0 2.0
END
