* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    135    205     397
    1     0 S   NP   _N1_     1    30.46499    96.42652   -25.41920
    2     1 S   H    _HN1     2     1.02791   130.66393  -115.28932
    3     1 S   H    _H1_     3     1.02954    76.62626   -12.47449
    4     1 S   H    _H2_     4     1.02829    32.92053  -169.74890
    5     1 S   CT   _CA1     5     1.50119   111.21353    94.50290
    6     5 S   HC   _HA1     6     1.09574   105.20221    94.44854
    7     5 S   CO3  _C1_     7     1.53762   112.46915   -25.78237
    8     7 S   O2Z  _O11     8     1.26365   115.00853   -42.92991
    9     7 S   O2Z  _O12     9     1.26240   114.93445   136.19735
   10     5 S   CT   _CB1    10     1.53057   107.39870  -147.61847
   11    10 S   HC   HB11    11     1.09837   109.29589   -50.28469
   12    10 S   HC   HB12    12     1.09816   110.44686    66.26170
   13    10 S   CT   _CG1    13     1.53017   112.69502  -171.31945
   14    13 S   HC   HG11    14     1.09580   110.62032   -66.03343
   15    13 S   HC   HG12    15     1.09660   109.84695    53.25114
   16    13 S   C    _CD1    16     1.51759   112.11663   173.62382
   17    16 S   O    _OE1    17     1.22765   123.25756     5.66126
   18    16 S   N    _N2_    18     1.38632   111.85712  -174.49177
   19    18 S   H    _HN2    19     1.01581   119.06794     2.91107
   20    18 S   CT1  _CA2    20     1.45921   122.67398   176.32070
   21    20 S   HC   _HA2    21     1.09409   109.92244    15.91315
   22    20 S   C    _C2_    22     1.52900   105.02624  -100.29895
   23    22 S   O    _O2_    23     1.22959   122.75139  -101.13722
   24    20 S   CTL  _CB2    32     1.53011   111.78493   139.44456
   25    24 S   HC   HB21    33     1.09661   110.09615    55.36600
   26    24 S   HC   HB22    34     1.09569   110.82993   172.74323
   27    22 S   N    _N3_    24     1.38464   112.89724    76.62403
   28    27 S   H    _HN3    25     1.01715   119.95807     1.24992
   29    24 S   S    _SG2    35     1.82851   114.01635   -63.94782
   30    27 S   CT   _CA3    26     1.45322   122.59477  -178.27036
   31    30 S   HC   HA31    27     1.09549   107.39874   -67.37811
   32    30 S   HC   HA32    28     1.09569   108.09030    48.88437
   33    29 S   S    _S1_    36     2.05744   103.39318   -67.04365
   34    30 S   CO3  _C3_    29     1.52894   114.36868   170.70147
   35    34 S   O2Z  _O31    30     1.26338   116.12688    -4.89473
   36    34 S   O2Z  _O32    31     1.26451   114.38947   175.48551
   37    33 S   CT   _C11    37     1.82540   101.70518   -78.66603
   38    37 S   HC   _H16    38     1.09642   106.73478   -52.18663
   39    37 S   HC   _H17    39     1.09032   109.16722    63.82439
   40    37 S   CT   _C10    40     1.53736   114.48638  -171.68818
   41    40 S   HC   _H6_    41     1.09799   106.68634   175.05930
   42    40 S   CT   _C9_    42     1.55694   117.77920   -60.98612
   43    42 S   SM   _S2_    43     1.89789   106.98778  -169.69305
   44    42 S   HC   _H5_    44     1.09627   108.23656    74.95336
   45    40 S   OH   _O33    71     1.44024   107.22190    62.06107
   46    45 S   HO   _H18    72     0.97178   107.53614    61.53484
   47    42 S   CT   _C8_    45     1.56339   118.86514   -50.40503
   48    47 S   HC   _H4_    46     1.10073   108.61157  -163.90100
   49    47 S   CT   _C7_    47     1.53969   115.55957   -43.73409
   50    49 S   HC   _H14    48     1.09265   114.78118    10.54359
   51    49 S   HC   _H15    49     1.09697   109.62347  -110.48513
   52    49 S   CT   _C6_    50     1.52198   105.26054   131.71371
   53    52 S   HC   _H12    51     1.09138   111.88177   148.43965
   54    52 S   HC   _H13    52     1.09793   109.33997   -94.75807
   55    52 S   CT   _C5_    53     1.53126   104.79070    22.42311
   56    55 S   HC   _H3_    54     1.09681   107.99298  -154.18222
   57    55 S   CT   _C12    55     1.56242   113.39311    84.53575
   58    57 S   HC   _H7_    56     1.09600   110.45492   -77.25232
   59    47 S   NT   _N4_    66     1.47996   115.07760    76.40567
   60    57 S   CT   _C13    57     1.54497   114.99956    45.66967
   61    60 S   HC   _H8_    58     1.09576   109.60037   -70.54338
   62    59 S   CT   _C4_    67     1.45493   113.24913    71.30970
   63    62 S   HC   _H9_    68     1.09402   111.11458   -65.22138
   64    62 S   HC   _H10    69     1.09459   110.78201   177.76629
   65    62 S   HC   _H11    70     1.09459   112.82316    55.06607
   66    60 S   CT   _C14    59     1.52954   110.95400   170.79361
   67    66 S   HC   _H19    60     1.09475   110.69882    70.83348
   68    66 S   HC   _H20    61     1.09393   111.84484  -167.75284
   69    60 S   OH   _O34    64     1.42781   111.10357    47.03781
   70    69 S   HO   _H21    65     0.97225   107.83992   179.10562
   71    66 S   S    _S3_    62     1.80661   107.98936   -47.74839
   72    57 S   S    _S4_    63     1.84136   111.49182   164.19103
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   6   3   2   7   4   5   5   4   3
   7   2   1   1  10   5   4  10   6  13   6   5   2   1  15   7
  10   6   5  10   5   4  14   6  12   7   6   8   7   3   2   1
   1   6   4   3   3   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    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    45  
   35    36  
   36  
    0  
   38    39    40    41    42    43    44    47    45    46  
   39    40    41    42    45  
   40    41    42    45  
   41    42    43    44    47    48    49    59    45    46  
   42    43    44    47    45    46  
   43    44    47    48    49    50    51    52    55    59    62    45    46  
   44    47    48    49    59    45  
   47    48    49    59    45  
   46    47  
    0  
   48    49    50    51    52    53    54    55    56    57    59    62    63    64    65  
   49    50    51    52    55    59    62  
   50    51    52    53    54    55    56    57    59    62  
   51    52    53    54    55    59  
   52    53    54    55    59  
   53    54    55    56    57    58    60    72    59    62  
   54    55    56    57    59  
   55    56    57    59  
   56    57    58    60    61    66    71    72    69    59    62    63    64    65  
   57    58    60    72    59    62  
   58    60    61    66    67    68    71    72    69    70    59    62  
   60    61    66    71    72    69    59  
   62    63    64    65    60    72  
   61    66    67    68    71    72    69    70  
   66    67    68    71    72    69    70  
   63    64    65  
   64    65  
   65  
    0  
   67    68    71    72    69    70  
   68    71    72    69  
   71    72    69  
   70    71    72  
    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   0.097500   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  -0.217500   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   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
   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   0.097500   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.200000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.6000   0.3550  -0.900000   2.0300   1.8000   0.025682759  -1.666211680
   44   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   45   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.157500   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   60   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.097500   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
   71   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
   72   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
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   166.000  2.038
   33    37   222.000  1.810
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    40   268.000  1.529
   40    41   340.000  1.090
   40    42   268.000  1.529
   40    45   320.000  1.410
   42    43   222.000  1.810
   42    44   340.000  1.090
   42    47   268.000  1.529
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    59   382.000  1.448
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    59   382.000  1.448
   57    58   340.000  1.090
   57    60   268.000  1.529
   57    72   222.000  1.810
   60    61   340.000  1.090
   60    66   268.000  1.529
   60    69   320.000  1.410
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   222.000  1.810
   71    72   166.000  2.038
   69    70   553.000  0.945
   59    62   382.000  1.448
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   45    46   553.000  0.945
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    50.00000  114.70000
   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    68.00000  103.70000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    68.00000  103.70000
   33    37    38    35.00000  109.50000
   33    37    39    35.00000  109.50000
   33    37    40    75.00000  111.63000
   37    40    41    37.50000  110.70000
   37    40    42    58.35000  112.70000
   37    40    45    50.00000  109.50000
   39    37    38    33.00000  107.80000
   40    37    38    37.50000  110.70000
   40    37    39    37.50000  110.70000
   40    42    43    75.00000  111.63000
   40    42    44    37.50000  110.70000
   40    42    47    58.35000  112.70000
   40    45    46    55.00000  108.50000
   42    40    41    37.50000  110.70000
   42    47    48    37.50000  110.70000
   42    47    49    58.35000  112.70000
   42    47    59    56.20000  109.47000
   44    42    43    35.00000  109.50000
   47    42    43    75.00000  111.63000
   47    42    44    37.50000  110.70000
   47    49    50    37.50000  110.70000
   47    49    51    37.50000  110.70000
   47    49    52    58.35000  112.70000
   47    59    55    51.80000  107.20000
   47    59    62    51.80000  107.20000
   49    47    48    37.50000  110.70000
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    55    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    55    56    37.50000  110.70000
   52    55    57    58.35000  112.70000
   52    55    59    56.20000  109.47000
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    57    58    37.50000  110.70000
   55    57    60    58.35000  112.70000
   55    57    72    75.00000  111.63000
   55    59    62    51.80000  107.20000
   57    55    56    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    66    58.35000  112.70000
   57    60    69    50.00000  109.50000
   57    72    71    68.00000  103.70000
   60    57    58    37.50000  110.70000
   60    66    67    37.50000  110.70000
   60    66    68    37.50000  110.70000
   60    66    71    75.00000  111.63000
   60    69    70    55.00000  108.50000
   66    60    61    37.50000  110.70000
   66    71    72    68.00000  103.70000
   68    66    67    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    68    35.00000  109.50000
   72    57    58    35.00000  109.50000
   72    57    60    75.00000  111.63000
   69    60    61    35.00000  109.50000
   69    60    66    50.00000  109.50000
   59    47    48    35.00000  109.50000
   59    47    49    56.20000  109.47000
   59    55    56    35.00000  109.50000
   59    55    57    56.20000  109.47000
   59    62    63    35.00000  109.50000
   59    62    64    35.00000  109.50000
   59    62    65    35.00000  109.50000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   45    40    41    35.00000  109.50000
   45    40    42    50.00000  109.50000
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   0.97050  1.0 1.0
   20    24    29    33  -0.41800 -1.0 2.0
   20    24    29    33   0.46750  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   0.22600  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  -3.49700 -1.0 2.0
   24    29    33    37   0.74750  1.0 3.0
   25    24    29    33   0.27900  1.0 3.0
   26    24    29    33   0.27900  1.0 3.0
   29    33    37    38   0.24000  1.0 3.0
   29    33    37    39   0.24000  1.0 3.0
   29    33    37    40   0.09450  1.0 1.0
   29    33    37    40  -0.17100 -1.0 2.0
   29    33    37    40   0.39100  1.0 3.0
   33    37    40    41   0.15000  1.0 3.0
   33    37    40    42   0.44750  1.0 1.0
   33    37    40    42  -0.17800 -1.0 2.0
   33    37    40    42   0.20200  1.0 3.0
   33    37    40    45   0.56750  1.0 1.0
   33    37    40    45  -0.07550 -1.0 2.0
   33    37    40    45   0.20000  1.0 3.0
   37    40    42    43   0.44750  1.0 1.0
   37    40    42    43  -0.17800 -1.0 2.0
   37    40    42    43   0.20200  1.0 3.0
   37    40    42    44   0.15000  1.0 3.0
   37    40    42    47   0.56750  1.0 1.0
   37    40    42    47  -0.07550 -1.0 2.0
   37    40    42    47   0.20000  1.0 3.0
   37    40    45    46  -0.11600  1.0 1.0
   37    40    45    46  -0.09450 -1.0 2.0
   37    40    45    46   0.21250  1.0 3.0
   38    37    40    41   0.15000  1.0 3.0
   38    37    40    42   0.15000  1.0 3.0
   38    37    40    45   0.23400  1.0 3.0
   39    37    40    41   0.15000  1.0 3.0
   39    37    40    42   0.15000  1.0 3.0
   39    37    40    45   0.23400  1.0 3.0
   40    42    47    48   0.15000  1.0 3.0
   40    42    47    49   0.56750  1.0 1.0
   40    42    47    49  -0.07550 -1.0 2.0
   40    42    47    49   0.20000  1.0 3.0
   40    42    47    59   1.53400  1.0 1.0
   40    42    47    59  -0.09950 -1.0 2.0
   40    42    47    59   0.05700  1.0 3.0
   41    40    42    43   0.15000  1.0 3.0
   41    40    42    44   0.15000  1.0 3.0
   41    40    42    47   0.15000  1.0 3.0
   41    40    45    46   0.19450  1.0 3.0
   42    40    45    46  -0.11600  1.0 1.0
   42    40    45    46  -0.09450 -1.0 2.0
   42    40    45    46   0.21250  1.0 3.0
   42    47    49    50   0.15000  1.0 3.0
   42    47    49    51   0.15000  1.0 3.0
   42    47    49    52   0.56750  1.0 1.0
   42    47    49    52  -0.07550 -1.0 2.0
   42    47    49    52   0.20000  1.0 3.0
   42    47    59    55   0.23450  1.0 1.0
   42    47    59    55   0.02050 -1.0 2.0
   42    47    59    55   0.25250  1.0 3.0
   42    47    59    62   0.23450  1.0 1.0
   42    47    59    62   0.02050 -1.0 2.0
   42    47    59    62   0.25250  1.0 3.0
   43    42    47    48   0.15000  1.0 3.0
   43    42    47    49   0.44750  1.0 1.0
   43    42    47    49  -0.17800 -1.0 2.0
   43    42    47    49   0.20200  1.0 3.0
   43    42    47    59   0.56750  1.0 1.0
   43    42    47    59  -0.07550 -1.0 2.0
   43    42    47    59   0.20000  1.0 3.0
   44    42    47    48   0.15000  1.0 3.0
   44    42    47    49   0.15000  1.0 3.0
   44    42    47    59   0.15000  1.0 3.0
   47    49    52    53   0.15000  1.0 3.0
   47    49    52    54   0.15000  1.0 3.0
   47    49   -52    55   0.56750  1.0 1.0
   47    49   -52    55  -0.07550 -1.0 2.0
   47    49   -52    55   0.20000  1.0 3.0
   47    59    62    63   0.28000  1.0 3.0
   47    59    62    64   0.28000  1.0 3.0
   47    59    62    65   0.28000  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    51   0.15000  1.0 3.0
   48    47    49    52   0.15000  1.0 3.0
   48    47    59    55   0.28000  1.0 3.0
   48    47    59    62   0.28000  1.0 3.0
   49    47   -59    55   0.23450  1.0 1.0
   49    47   -59    55   0.02050 -1.0 2.0
   49    47   -59    55   0.25250  1.0 3.0
   49    47    59    62   0.58650  1.0 1.0
   49    47    59    62   0.12600 -1.0 2.0
   49    47    59    62   0.33350  1.0 3.0
   49    52    55    56   0.15000  1.0 3.0
   49    52    55    57   0.56750  1.0 1.0
   49    52    55    57  -0.07550 -1.0 2.0
   49    52    55    57   0.20000  1.0 3.0
   49    52   -55    59   1.53400  1.0 1.0
   49    52   -55    59  -0.09950 -1.0 2.0
   49    52   -55    59   0.05700  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    55   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54   0.15000  1.0 3.0
   51    49    52    55   0.15000  1.0 3.0
   52    55    57    58   0.15000  1.0 3.0
   52    55    57    60   0.56750  1.0 1.0
   52    55    57    60  -0.07550 -1.0 2.0
   52    55    57    60   0.20000  1.0 3.0
   52    55    57    72   0.44750  1.0 1.0
   52    55    57    72  -0.17800 -1.0 2.0
   52    55    57    72   0.20200  1.0 3.0
   52    55   -59    47   0.23450  1.0 1.0
   52    55   -59    47   0.02050 -1.0 2.0
   52    55   -59    47   0.25250  1.0 3.0
   52    55    59    62   0.58650  1.0 1.0
   52    55    59    62   0.12600 -1.0 2.0
   52    55    59    62   0.33350  1.0 3.0
   53    52    55    56   0.15000  1.0 3.0
   53    52    55    57   0.15000  1.0 3.0
   53    52    55    59   0.15000  1.0 3.0
   54    52    55    56   0.15000  1.0 3.0
   54    52    55    57   0.15000  1.0 3.0
   54    52    55    59   0.15000  1.0 3.0
   55    57    60    61   0.15000  1.0 3.0
   55    57    60    66   0.56750  1.0 1.0
   55    57    60    66  -0.07550 -1.0 2.0
   55    57    60    66   0.20000  1.0 3.0
   55    57    60    69   0.86500  1.0 1.0
   55    57    60    69  -0.17500 -1.0 2.0
   55    57    60    69   0.20800  1.0 3.0
   55    57    72    71   0.09450  1.0 1.0
   55    57    72    71  -0.17100 -1.0 2.0
   55    57    72    71   0.39100  1.0 3.0
   55    59    62    63   0.28000  1.0 3.0
   55    59    62    64   0.28000  1.0 3.0
   55    59    62    65   0.28000  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55    57    60   0.15000  1.0 3.0
   56    55    57    72   0.15000  1.0 3.0
   56    55    59    47   0.28000  1.0 3.0
   56    55    59    62   0.28000  1.0 3.0
   57    55    59    47   0.23450  1.0 1.0
   57    55    59    47   0.02050 -1.0 2.0
   57    55    59    47   0.25250  1.0 3.0
   57    55    59    62   0.23450  1.0 1.0
   57    55    59    62   0.02050 -1.0 2.0
   57    55    59    62   0.25250  1.0 3.0
   57    60    66    67   0.15000  1.0 3.0
   57    60    66    68   0.15000  1.0 3.0
   57    60   -66    71   0.44750  1.0 1.0
   57    60   -66    71  -0.17800 -1.0 2.0
   57    60   -66    71   0.20200  1.0 3.0
   57    60    69    70  -0.11600  1.0 1.0
   57    60    69    70  -0.09450 -1.0 2.0
   57    60    69    70   0.21250  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    66   0.15000  1.0 3.0
   58    57    60    69   0.23400  1.0 3.0
   58    57    72    71   0.24000  1.0 3.0
   60    57   -72    71   0.09450  1.0 1.0
   60    57   -72    71  -0.17100 -1.0 2.0
   60    57   -72    71   0.39100  1.0 3.0
   60    66   -71    72   0.09450  1.0 1.0
   60    66   -71    72  -0.17100 -1.0 2.0
   60    66   -71    72   0.39100  1.0 3.0
   61    60    66    67   0.15000  1.0 3.0
   61    60    66    68   0.15000  1.0 3.0
   61    60    66    71   0.15000  1.0 3.0
   61    60    69    70   0.19450  1.0 3.0
   66    60    69    70  -0.11600  1.0 1.0
   66    60    69    70  -0.09450 -1.0 2.0
   66    60    69    70   0.21250  1.0 3.0
   66    71   -72    57  -3.49700 -1.0 2.0
   66    71   -72    57   0.74750  1.0 3.0
   67    66    71    72   0.24000  1.0 3.0
   68    66    71    72   0.24000  1.0 3.0
   72    57    60    61   0.15000  1.0 3.0
   72    57   -60    66   0.44750  1.0 1.0
   72    57   -60    66  -0.17800 -1.0 2.0
   72    57   -60    66   0.20200  1.0 3.0
   72    57    60    69   0.56750  1.0 1.0
   72    57    60    69  -0.07550 -1.0 2.0
   72    57    60    69   0.20000  1.0 3.0
   69    60    66    67   0.23400  1.0 3.0
   69    60    66    68   0.23400  1.0 3.0
   69    60    66    71   0.56750  1.0 1.0
   69    60    66    71  -0.07550 -1.0 2.0
   69    60    66    71   0.20000  1.0 3.0
   59    47    49    50   0.15000  1.0 3.0
   59    47    49    51   0.15000  1.0 3.0
   59    47   -49    52   1.53400  1.0 1.0
   59    47   -49    52  -0.09950 -1.0 2.0
   59    47   -49    52   0.05700  1.0 3.0
   59    55    57    58   0.15000  1.0 3.0
   59    55    57    60   1.53400  1.0 1.0
   59    55    57    60  -0.09950 -1.0 2.0
   59    55    57    60   0.05700  1.0 3.0
   59    55    57    72   0.56750  1.0 1.0
   59    55    57    72  -0.07550 -1.0 2.0
   59    55    57    72   0.20000  1.0 3.0
   45    40    42    43   0.56750  1.0 1.0
   45    40    42    43  -0.07550 -1.0 2.0
   45    40    42    43   0.20000  1.0 3.0
   45    40    42    44   0.23400  1.0 3.0
   45    40    42    47   0.86500  1.0 1.0
   45    40    42    47  -0.17500 -1.0 2.0
   45    40    42    47   0.20800  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
END
