* LIGAND DATABASE FILE (OPLS2005)
*
001      73    76    145    236     424
    1     0 S   NP   _N1_     1    28.77092    96.28988   -23.08997
    2     1 S   H    _HN1     2     1.02786   101.98637   -93.08534
    3     1 S   H    _H1_     3     1.02951    73.73988    12.79097
    4     1 S   H    _H2_     4     1.02829    38.03297   163.13248
    5     1 S   CT   _CA1     5     1.50113   141.15990   115.31306
    6     5 S   HC   _HA1     6     1.09573   105.20044    88.43068
    7     5 S   CO3  _C1_     7     1.53798   112.48341   -31.81138
    8     7 S   O2Z  _O11     8     1.26373   115.00474   -41.92569
    9     7 S   O2Z  _O12     9     1.26242   114.95637   137.24259
   10     5 S   CT   _CB1    10     1.53086   107.42796  -153.56386
   11    10 S   HC   HB11    11     1.09831   109.39460   -49.62015
   12    10 S   HC   HB12    12     1.09813   110.43368    67.00085
   13    10 S   CT   _CG1    13     1.52978   112.59195  -170.60288
   14    13 S   HC   HG11    14     1.09590   110.60911   -65.17673
   15    13 S   HC   HG12    15     1.09669   109.80992    54.04613
   16    13 S   C    _CD1    16     1.51796   112.29444   174.51448
   17    16 S   O    _OE1    17     1.22718   123.31482     5.45560
   18    16 S   N    _N2_    18     1.38618   111.57865  -174.59253
   19    18 S   H    _HN2    19     1.01575   118.94006     2.12339
   20    18 S   CT1  _CA2    20     1.46255   123.54352   178.50734
   21    20 S   HC   _HA2    21     1.09729   109.39833     3.42714
   22    20 S   C    _C2_    22     1.53558   108.67850  -112.16730
   23    22 S   O    _O2_    23     1.23061   122.31239  -148.41036
   24    20 S   CT   _CB2    32     1.53263   111.23194   125.47208
   25    24 S   HC   HB21    33     1.09497   109.78400    55.67657
   26    24 S   HC   HB22    34     1.09513   110.59238   174.60664
   27    22 S   N    _N3_    24     1.38345   113.73700    39.07576
   28    27 S   H    _HN3    25     1.01577   119.56496    -3.30162
   29    24 S   S    _SG2    35     1.82669   111.40818   -65.80302
   30    27 S   CT   _CA3    26     1.45282   123.20934   177.14186
   31    30 S   HC   HA31    27     1.09549   107.50499   -64.72160
   32    30 S   HC   HA32    28     1.09557   107.99041    51.71536
   33    29 S   CT   _C13    36     1.82606    99.28753   167.95610
   34    33 S   HC   _H5_    37     1.09922   109.16278    29.92064
   35    30 S   CO3  _C3_    29     1.52957   114.08975   173.71809
   36    35 S   O2Z  _O31    30     1.26375   116.07208    -0.62464
   37    35 S   O2Z  _O32    31     1.26430   114.40981   179.43525
   38    33 S   CT   _C14    38     1.55319   110.77456   152.43498
   39    38 S   OM   _O37    39     1.32542   110.49232   -79.93249
   40    38 S   HC   _H6_    40     1.09956   104.81856    50.62415
   41    38 S   CT   _C15    41     1.58731   103.13590   162.50569
   42    41 S   CT   _C16    42     1.55942   113.11661  -162.65120
   43    42 S   HC   _H7_    43     1.09551   112.48665   -86.46898
   44    41 S   CT   _C10    52     1.58607   104.30603   -36.57283
   45    41 S   OH   _O36    72     1.44073   108.90514    78.72757
   46    45 S   HO   _H17    73     0.97493   105.90848    39.07973
   47    42 S   CO4  _C17    44     1.51703   110.74496    36.43645
   48    47 S   O    _O34    45     1.21972   127.05383   -94.96560
   49    33 S   C3T  _C11    53     1.51574   114.17180   -92.89583
   50    44 S   CT   _C18    58     1.55335   112.31322   133.66620
   51    50 S   HC   _H18    59     1.09714   111.46291   -65.60805
   52    50 S   HC   _H19    60     1.09635   111.17676   175.49237
   53    50 S   HC   _H20    61     1.08609   113.37667    54.19605
   54    47 S   OS   _O35    46     1.37297   108.11483    84.84651
   55    49 S   C3T  _C12    54     1.53296   126.38343    16.18209
   56    55 S   HC   _H15    55     1.08288   119.58397  -160.51837
   57    55 S   HC   _H16    56     1.08120   120.41448   -11.84560
   58    54 S   CT   _C8_    47     1.44663   107.95240     5.81194
   59    58 S   HC   _H4_    48     1.09492   107.19128   145.67303
   60    49 S   O3T  _O33    57     1.44802   112.01900    80.36186
   61    58 S   CT   _C9_    49     1.53963   107.55504   -94.88566
   62    61 S   HC   _H13    50     1.09706   108.33269  -149.23303
   63    61 S   HC   _H14    51     1.09745   107.02721   -35.60588
   64    42 S   CT   _C7_    62     1.53664   115.70569   144.91990
   65    64 S   HC   _H3_    63     1.10515   106.15103  -177.13461
   66    64 S   CM   _C5_    64     1.50798   121.48265    66.01689
   67    66 S   CM   _C6_    65     1.34411   123.22065  -141.55751
   68    67 S   HC   _H11    66     1.08553   121.21789  -177.45932
   69    67 S   HC   _H12    67     1.08383   122.26144     2.40387
   70    66 S   CT   _C4_    68     1.50487   116.48276    43.88452
   71    70 S   HC   _H8_    69     1.09269   110.96804   -68.10368
   72    70 S   HC   _H9_    70     1.09501   110.25570    52.21643
   73    70 S   HC   _H10    71     1.09540   112.14039   171.82106
  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  10   5   4   3
  15   8   2   1   1  15   6   5  22  17   9  19   6   1   8   3
  12   9   3   2   1   8   4   2   1   9   6   1   5   2   1   9
   3   7   6   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44    49    55    60  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    61    44    49    55    56    57    60    50    45  
   38    39    40    41    44    49    55    60  
   36    37  
   37  
    0  
   39    40    41    42    43    47    61    44    49    55    60    50    64    45    46  
   40    41    42    44    49    45  
   41    42    44    49    45  
   42    43    47    48    54    58    61    62    63    44    49    55    60    50    51    52    53    64    65    66    45    46  
   43    47    48    54    58    59    61    44    49    50    64    65    66    67    70    45    46  
   47    48    54    58    44    64    65    66    45  
   49    55    56    57    60    50    51    52    53    64    45    46    47    54    58    59    61    62    63  
   46    47    49    50    61    64  
    0  
   48    54    58    59    61    64    65    66  
   54    58    64  
   55    56    57    60    50    51    52    53    58    61    62    63  
   51    52    53    55    58    60    61    62    63  
   52    53    61  
   53    61  
   61  
   58    59    61    62    63    64    65    66  
   56    57    60    61  
   57    60  
   60  
   59    61    62    63    64    65    66    67    70  
   61    62    63    64    65    66  
   61  
   62    63    64    65    66  
   63    64  
   64  
   65    66    67    68    69    70    71    72    73  
   66    67    70  
   67    68    69    70    71    72    73  
   68    69    70    71    72    73  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   40   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0660   0.056200   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   268.000  1.529
   33    49   275.000  1.510
   38    39   570.000  1.307
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   268.000  1.529
   41    44   268.000  1.529
   41    45   320.000  1.410
   42    43   340.000  1.090
   42    47   317.000  1.522
   42    64   268.000  1.529
   47    48   570.000  1.229
   47    54   214.000  1.327
   54    58   320.000  1.410
   58    59   340.000  1.090
   58    61   268.000  1.529
   58    64   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    44   268.000  1.529
   44    49   275.000  1.510
   44    50   268.000  1.529
   49    55   260.000  1.509
   49    60   335.000  1.432
   55    56   340.000  1.088
   55    57   340.000  1.088
   55    60   335.000  1.432
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   64    65   340.000  1.090
   64    66   317.000  1.510
   66    67   549.000  1.340
   66    70   317.000  1.510
   67    68   340.000  1.080
   67    69   340.000  1.080
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   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    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  111.63000
   29    33    49    75.00000  111.63000
   33    38    39    50.00000  109.50000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    49    44    58.35000  112.70000
   33    49    55    60.00000  120.94000
   33    49    60    80.00000  116.47100
   38    33    34    37.50000  110.70000
   38    41    42    58.35000  112.70000
   38    41    44    58.35000  112.70000
   38    41    45    50.00000  109.50000
   40    38    39    45.00000  125.66300
   41    38    39    50.00000  109.50000
   41    38    40    37.50000  110.70000
   41    42    43    37.50000  110.70000
   41    42    47    63.00000  111.10000
   41    42    64    58.35000  112.70000
   41    44    61    58.35000  112.70000
   41    44    49    70.00000  112.37300
   41    44    50    58.35000  112.70000
   41    45    46    55.00000  108.50000
   42    47    48    80.00000  120.40000
   42    47    54    81.00000  111.40000
   42    64    58    58.35000  112.70000
   42    64    65    37.50000  110.70000
   42    64    66    70.00000  112.02700
   47    42    43    35.00000  109.50000
   47    54    58    83.00000  116.90000
   54    47    48    83.00000  123.40000
   54    58    59    35.00000  109.50000
   54    58    61    50.00000  109.50000
   54    58    64    50.00000  109.50000
   58    61    62    37.50000  110.70000
   58    61    63    37.50000  110.70000
   58    61    44    58.35000  112.70000
   58    64    65    37.50000  110.70000
   58    64    66    70.00000  112.02700
   61    58    59    37.50000  110.70000
   61    44    49    70.00000  112.37300
   61    44    50    58.35000  112.70000
   63    61    62    33.00000  107.80000
   44    41    42    58.35000  112.70000
   44    61    62    37.50000  110.70000
   44    61    63    37.50000  110.70000
   44    49    55    60.00000  120.94000
   44    49    60    80.00000  116.47100
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   49    33    34    45.00000  109.38400
   49    33    38    70.00000  112.37300
   49    55    56    37.50000  117.20000
   49    55    57    37.50000  117.20000
   49    55    60    15.00000   60.43100
   49    60    55    15.00000   59.14900
   57    55    56    35.00000  114.30000
   60    49    55    15.00000   60.43100
   60    55    56    50.00000  114.27700
   60    55    57    50.00000  114.27700
   50    44    49    70.00000  112.37300
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   64    42    43    37.50000  110.70000
   64    42    47    63.00000  111.10000
   64    58    59    37.50000  110.70000
   64    58    61    58.35000  112.70000
   64    66    67    70.00000  124.00000
   64    66    70    65.00000  117.92700
   66    64    65    35.00000  109.50000
   66    67    68    35.00000  120.00000
   66    67    69    35.00000  120.00000
   66    70    71    35.00000  109.50000
   66    70    72    35.00000  109.50000
   66    70    73    35.00000  109.50000
   69    67    68    35.00000  117.00000
   70    66    67    70.00000  124.00000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   45    41    42    50.00000  109.50000
   45    41    44    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   0.01700  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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    49    44   0.44750  1.0 1.0
   29    33    49    44  -0.17800 -1.0 2.0
   29    33    49    44   0.20200  1.0 3.0
   29    33    49    55   0.44750  1.0 1.0
   29    33    49    55  -0.17800 -1.0 2.0
   29    33    49    55   0.20200  1.0 3.0
   29    33    49    60   0.56750  1.0 1.0
   29    33    49    60  -0.07550 -1.0 2.0
   29    33    49    60   0.20000  1.0 3.0
   33    38    41    42   0.56750  1.0 1.0
   33    38    41    42  -0.07550 -1.0 2.0
   33    38    41    42   0.20000  1.0 3.0
   33    38   -41    44   0.56750  1.0 1.0
   33    38   -41    44  -0.07550 -1.0 2.0
   33    38   -41    44   0.20000  1.0 3.0
   33    38    41    45   0.86500  1.0 1.0
   33    38    41    45  -0.17500 -1.0 2.0
   33    38    41    45   0.20800  1.0 3.0
   33    49    55    56   0.15000  1.0 3.0
   33    49    55    57   0.15000  1.0 3.0
   33    49   -55    60   0.02550  1.0 1.0
   33    49   -55    60  -0.02600 -1.0 2.0
   33    49   -55    60   1.20400  1.0 3.0
   33    49   -60    55   0.06250  1.0 1.0
   33    49   -60    55  -0.01100 -1.0 2.0
   33    49   -60    55   0.28050  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    49    44   0.15000  1.0 3.0
   34    33    49    55   0.15000  1.0 3.0
   34    33    49    60   0.23400  1.0 3.0
   38    33   -49    44   0.56750  1.0 1.0
   38    33   -49    44  -0.07550 -1.0 2.0
   38    33   -49    44   0.20000  1.0 3.0
   38    33    49    55   0.07850  1.0 1.0
   38    33    49    55  -0.03950 -1.0 2.0
   38    33    49    55   0.67350  1.0 3.0
   38    33    49    60   0.02550  1.0 1.0
   38    33    49    60  -0.02600 -1.0 2.0
   38    33    49    60   1.20400  1.0 3.0
   38    41    42    43   0.15000  1.0 3.0
   38    41    42    47  -0.95700  1.0 1.0
   38    41    42    47  -0.18200 -1.0 2.0
   38    41    42    47   0.29450  1.0 3.0
   38    41    42    64   0.56750  1.0 1.0
   38    41    42    64  -0.07550 -1.0 2.0
   38    41    42    64   0.20000  1.0 3.0
   38    41    44    61   0.56750  1.0 1.0
   38    41    44    61  -0.07550 -1.0 2.0
   38    41    44    61   0.20000  1.0 3.0
   38    41   -44    49   0.47050  1.0 1.0
   38    41   -44    49   0.03900 -1.0 2.0
   38    41   -44    49   0.20100  1.0 3.0
   38    41    44    50   0.56750  1.0 1.0
   38    41    44    50  -0.07550 -1.0 2.0
   38    41    44    50   0.20000  1.0 3.0
   38    41    45    46  -0.11600  1.0 1.0
   38    41    45    46  -0.09450 -1.0 2.0
   38    41    45    46   0.21250  1.0 3.0
   39    38    41    42   0.62750  1.0 1.0
   39    38    41    42  -0.30950 -1.0 2.0
   39    38    41    42   0.27300  1.0 3.0
   39    38    41    44   0.62750  1.0 1.0
   39    38    41    44  -0.30950 -1.0 2.0
   39    38    41    44   0.27300  1.0 3.0
   39    38    41    45   3.69350  1.0 1.0
   39    38    41    45  -1.82950 -1.0 2.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    44   0.15000  1.0 3.0
   40    38    41    45   0.23400  1.0 3.0
   41    42    47    48   0.30150 -1.0 2.0
   41    42    47    54   0.36750  1.0 3.0
   41    42    64    58   0.56750  1.0 1.0
   41    42    64    58  -0.07550 -1.0 2.0
   41    42    64    58   0.20000  1.0 3.0
   41    42    64    65   0.15000  1.0 3.0
   41    42    64    66   0.34400  1.0 1.0
   41    42    64    66   0.09450 -1.0 2.0
   41    42    64    66   0.11100  1.0 3.0
   41    44   -49    33   0.56750  1.0 1.0
   41    44   -49    33  -0.07550 -1.0 2.0
   41    44   -49    33   0.20000  1.0 3.0
   41    44    49    55   0.07850  1.0 1.0
   41    44    49    55  -0.03950 -1.0 2.0
   41    44    49    55   0.67350  1.0 3.0
   41    44    49    60   0.02550  1.0 1.0
   41    44    49    60  -0.02600 -1.0 2.0
   41    44    49    60   1.20400  1.0 3.0
   41    44    50    51   0.15000  1.0 3.0
   41    44    50    52   0.15000  1.0 3.0
   41    44    50    53   0.15000  1.0 3.0
   42    41    44    61   0.56750  1.0 1.0
   42    41    44    61  -0.07550 -1.0 2.0
   42    41    44    61   0.20000  1.0 3.0
   42    41    44    49   0.47050  1.0 1.0
   42    41    44    49   0.03900 -1.0 2.0
   42    41    44    49   0.20100  1.0 3.0
   42    41    44    50   0.56750  1.0 1.0
   42    41    44    50  -0.07550 -1.0 2.0
   42    41    44    50   0.20000  1.0 3.0
   42    41    45    46  -0.11600  1.0 1.0
   42    41    45    46  -0.09450 -1.0 2.0
   42    41    45    46   0.21250  1.0 3.0
   42    47   -54    58   1.63150  1.0 1.0
   42    47   -54    58   2.92000 -1.0 2.0
   42    64    66    67   0.09850  1.0 1.0
   42    64    66    67   0.15250 -1.0 2.0
   42    64    66    67  -0.50650  1.0 3.0
   42    64    66    70   0.46850  1.0 1.0
   42    64    66    70   0.08550 -1.0 2.0
   42    64    66    70   0.09800  1.0 3.0
   43    42    47    48   0.00000  1.0 1.0
   43    42    47    54   0.00000  1.0 1.0
   43    42    64    58   0.15000  1.0 3.0
   43    42    64    65   0.15000  1.0 3.0
   43    42    64    66   0.15000  1.0 3.0
   47    42   -64    58  -0.95700  1.0 1.0
   47    42   -64    58  -0.18200 -1.0 2.0
   47    42   -64    58   0.29450  1.0 3.0
   47    42    64    65  -0.11250  1.0 3.0
   47    42    64    66  -0.98800  1.0 1.0
   47    42    64    66   0.48800 -1.0 2.0
   47    42    64    66   0.76800  1.0 3.0
   47    54    58    59   0.08050  1.0 3.0
   47    54    58    61  -0.25900  1.0 1.0
   47    54    58    61  -0.47000 -1.0 2.0
   47    54    58    61   0.11750  1.0 3.0
   47    54   -58    64  -0.25900  1.0 1.0
   47    54   -58    64  -0.47000 -1.0 2.0
   47    54   -58    64   0.11750  1.0 3.0
   48    47    54    58   3.00000 -1.0 2.0
   54    58    61    62   0.23400  1.0 3.0
   54    58    61    63   0.23400  1.0 3.0
   54    58    61    44   0.62750  1.0 1.0
   54    58    61    44  -0.30950 -1.0 2.0
   54    58    61    44   0.27300  1.0 3.0
   54    58   -64    42   0.62750  1.0 1.0
   54    58   -64    42  -0.30950 -1.0 2.0
   54    58   -64    42   0.27300  1.0 3.0
   54    58    64    65   0.23400  1.0 3.0
   54    58    64    66   0.61850  1.0 1.0
   54    58    64    66  -0.22750 -1.0 2.0
   54    58    64    66   0.15300  1.0 3.0
   58    61   -44    41   0.56750  1.0 1.0
   58    61   -44    41  -0.07550 -1.0 2.0
   58    61   -44    41   0.20000  1.0 3.0
   58    61    44    49   0.47050  1.0 1.0
   58    61    44    49   0.03900 -1.0 2.0
   58    61    44    49   0.20100  1.0 3.0
   58    61    44    50   0.56750  1.0 1.0
   58    61    44    50  -0.07550 -1.0 2.0
   58    61    44    50   0.20000  1.0 3.0
   58    64    66    67   0.09850  1.0 1.0
   58    64    66    67   0.15250 -1.0 2.0
   58    64    66    67  -0.50650  1.0 3.0
   58    64    66    70   0.46850  1.0 1.0
   58    64    66    70   0.08550 -1.0 2.0
   58    64    66    70   0.09800  1.0 3.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    63   0.15000  1.0 3.0
   59    58    61    44   0.15000  1.0 3.0
   59    58    64    42   0.15000  1.0 3.0
   59    58    64    65   0.15000  1.0 3.0
   59    58    64    66   0.15000  1.0 3.0
   61    58   -64    42   0.56750  1.0 1.0
   61    58   -64    42  -0.07550 -1.0 2.0
   61    58   -64    42   0.20000  1.0 3.0
   61    58    64    65   0.15000  1.0 3.0
   61    58    64    66   0.34400  1.0 1.0
   61    58    64    66   0.09450 -1.0 2.0
   61    58    64    66   0.11100  1.0 3.0
   61    44    49    33   0.56750  1.0 1.0
   61    44    49    33  -0.07550 -1.0 2.0
   61    44    49    33   0.20000  1.0 3.0
   61    44    49    55   0.07850  1.0 1.0
   61    44    49    55  -0.03950 -1.0 2.0
   61    44    49    55   0.67350  1.0 3.0
   61    44    49    60   0.02550  1.0 1.0
   61    44    49    60  -0.02600 -1.0 2.0
   61    44    49    60   1.20400  1.0 3.0
   61    44    50    51   0.15000  1.0 3.0
   61    44    50    52   0.15000  1.0 3.0
   61    44    50    53   0.15000  1.0 3.0
   62    61    44    41   0.15000  1.0 3.0
   62    61    44    49   0.15000  1.0 3.0
   62    61    44    50   0.15000  1.0 3.0
   63    61    44    41   0.15000  1.0 3.0
   63    61    44    49   0.15000  1.0 3.0
   63    61    44    50   0.15000  1.0 3.0
   44    41    42    43   0.15000  1.0 3.0
   44    41    42    47  -0.95700  1.0 1.0
   44    41    42    47  -0.18200 -1.0 2.0
   44    41    42    47   0.29450  1.0 3.0
   44    41    42    64   0.56750  1.0 1.0
   44    41    42    64  -0.07550 -1.0 2.0
   44    41    42    64   0.20000  1.0 3.0
   44    41    45    46  -0.11600  1.0 1.0
   44    41    45    46  -0.09450 -1.0 2.0
   44    41    45    46   0.21250  1.0 3.0
   44    49    55    56   0.15000  1.0 3.0
   44    49    55    57   0.15000  1.0 3.0
   44    49   -55    60   0.02550  1.0 1.0
   44    49   -55    60  -0.02600 -1.0 2.0
   44    49   -55    60   1.20400  1.0 3.0
   44    49   -60    55   0.06250  1.0 1.0
   44    49   -60    55  -0.01100 -1.0 2.0
   44    49   -60    55   0.28050  1.0 3.0
   49    33    38    39  -0.26800  1.0 1.0
   49    33    38    39   0.69150 -1.0 2.0
   49    33    38    39  -0.48750  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33   -38    41   0.47050  1.0 1.0
   49    33   -38    41   0.03900 -1.0 2.0
   49    33   -38    41   0.20100  1.0 3.0
   49    44    50    51   0.15000  1.0 3.0
   49    44    50    52   0.15000  1.0 3.0
   49    44    50    53   0.15000  1.0 3.0
   56    55   -60    49   0.36800  1.0 3.0
   57    55   -60    49   0.36800  1.0 3.0
   60    49   -55    56   0.23400  1.0 3.0
   60    49   -55    57   0.23400  1.0 3.0
   50    44    49    33   0.56750  1.0 1.0
   50    44    49    33  -0.07550 -1.0 2.0
   50    44    49    33   0.20000  1.0 3.0
   50    44    49    55   0.07850  1.0 1.0
   50    44    49    55  -0.03950 -1.0 2.0
   50    44    49    55   0.67350  1.0 3.0
   50    44    49    60   0.02550  1.0 1.0
   50    44    49    60  -0.02600 -1.0 2.0
   50    44    49    60   1.20400  1.0 3.0
   64    42    47    48   0.30150 -1.0 2.0
   64    42   -47    54   0.36750  1.0 3.0
   64    58    61    62   0.15000  1.0 3.0
   64    58    61    63   0.15000  1.0 3.0
   64    58   -61    44   0.56750  1.0 1.0
   64    58   -61    44  -0.07550 -1.0 2.0
   64    58   -61    44   0.20000  1.0 3.0
   64    66    67    68   7.00000 -1.0 2.0
   64    66    67    69   7.00000 -1.0 2.0
   64    66    70    71   0.34800  1.0 3.0
   64    66    70    72   0.34800  1.0 3.0
   64    66    70    73   0.34800  1.0 3.0
   65    64    66    67   0.00000  1.0 1.0
   65    64    66    70   0.34800  1.0 3.0
   67    66    70    71   0.00000  1.0 1.0
   67    66    70    72   0.00000  1.0 1.0
   67    66    70    73   0.00000  1.0 1.0
   70    66    67    68   7.00000 -1.0 2.0
   70    66    67    69   7.00000 -1.0 2.0
   45    41    42    43   0.23400  1.0 3.0
   45    41    42    47  -0.09450  1.0 1.0
   45    41    42    47  -1.12950 -1.0 2.0
   45    41    42    47   0.54000  1.0 3.0
   45    41    42    64   0.86500  1.0 1.0
   45    41    42    64  -0.17500 -1.0 2.0
   45    41    42    64   0.20800  1.0 3.0
   45    41    44    61   0.86500  1.0 1.0
   45    41    44    61  -0.17500 -1.0 2.0
   45    41    44    61   0.20800  1.0 3.0
   45    41    44    49   0.86500  1.0 1.0
   45    41    44    49  -0.17500 -1.0 2.0
   45    41    44    49   0.20800  1.0 3.0
   45    41    44    50   0.86500  1.0 1.0
   45    41    44    50  -0.17500 -1.0 2.0
   45    41    44    50   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
   36    30    35    37  10.50000 -1.0 2.0
   42    54    47    48  10.50000 -1.0 2.0
   64    70    66    67  15.00000 -1.0 2.0
   68    69    67    66  15.00000 -1.0 2.0
END
