* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    130    197     372
    1     0 S   NP   _N1_     1    28.38637    94.49086   -24.58118
    2     1 S   H    _HN1     2     1.02777   110.57249  -106.51413
    3     1 S   H    _H1_     3     1.02958    88.00817     2.33959
    4     1 S   H    _H2_     4     1.02836    19.69155   167.77687
    5     1 S   CT   _CA1     5     1.50124   123.96433   115.72719
    6     5 S   HC   _HA1     6     1.09574   105.22398    75.68454
    7     5 S   CO3  _C1_     7     1.53790   112.36849   -44.52100
    8     7 S   O2Z  _O11     8     1.26364   115.00000   -43.96928
    9     7 S   O2Z  _O12     9     1.26237   114.93306   135.17162
   10     5 S   CT   _CB1    10     1.53100   107.42591  -166.39876
   11    10 S   HC   HB11    11     1.09826   109.34598   -50.56463
   12    10 S   HC   HB12    12     1.09816   110.42114    65.99577
   13    10 S   CT   _CG1    13     1.53012   112.66158  -171.63881
   14    13 S   HC   HG11    14     1.09595   110.48029   -64.04085
   15    13 S   HC   HG12    15     1.09656   109.92858    55.15295
   16    13 S   C    _CD1    16     1.51839   112.33850   175.53331
   17    16 S   O    _OE1    17     1.22736   123.29005    -0.36584
   18    16 S   N    _N2_    18     1.38545   111.67407   179.66080
   19    18 S   H    _HN2    19     1.01555   119.01064     4.64949
   20    18 S   CT1  _CA2    20     1.45836   122.92565   178.20823
   21    20 S   HC   _HA2    21     1.09708   109.06299    24.03773
   22    20 S   C    _C2_    22     1.52792   106.77236   -93.49871
   23    22 S   O    _O2_    23     1.23015   122.77040   -33.32606
   24    20 S   CT   _CB2    32     1.53202   112.10701   147.44220
   25    24 S   HC   HB21    33     1.09499   109.82331    52.67019
   26    24 S   HC   HB22    34     1.09054   109.63423   170.85123
   27    22 S   N    _N3_    24     1.38508   112.78149   149.61680
   28    27 S   H    _HN3    25     1.01675   120.36534    -2.75413
   29    24 S   S    _SG2    35     1.82606   110.77023   -67.89826
   30    27 S   CT   _CA3    26     1.45375   122.17779   178.05388
   31    30 S   HC   HA31    27     1.09577   107.19705   -65.32772
   32    30 S   HC   HA32    28     1.09560   108.21809    50.87858
   33    29 S   CT   _C17    36     1.87772   101.42439  -174.44325
   34    30 S   CO3  _C3_    29     1.52777   114.27504   172.49923
   35    34 S   O2Z  _O31    30     1.26300   115.89395   -22.72945
   36    34 S   O2Z  _O32    31     1.26421   114.59039   157.51464
   37    33 S   CM   _C16    37     1.52604   106.81937  -154.75371
   38    37 S   HC   _H9_    38     1.08961   117.88068    31.91028
   39    33 S   OS   _O35    68     1.45038   111.12535   -34.44655
   40    37 S   CMA  _C15    39     1.34966   123.99225  -150.15939
   41    40 S   OM   _O36    40     1.25896   130.90611  -178.38650
   42    39 S   CT   _C18    69     1.42208   117.44110   -74.29393
   43    42 S   HC   _H10    70     1.09376   107.80038   168.61097
   44    42 S   HC   _H11    71     1.09318   112.10666    49.67749
   45    42 S   HC   _H12    72     1.09368   110.65513   -73.96091
   46    40 S   CM   _C14    41     1.46121   117.62291    -1.11960
   47    46 S   HC   _H8_    42     1.08999   118.36706  -162.25745
   48    46 S   CM   _C13    43     1.34562   121.73997    18.20074
   49    33 S   CT   _C11    44     1.58029   112.02111    84.57650
   50    48 S   CO4  _C19    61     1.47908   115.79850  -179.28838
   51    50 S   O    _O37    62     1.22230   124.06520    49.49982
   52    49 S   CO4  _C12    45     1.52829   114.42311    37.35444
   53    52 S   O    _O34    46     1.21768   126.92912    62.63579
   54    49 S   OS   _O33    56     1.45341   109.61633   -79.98667
   55    50 S   OS   _O38    63     1.35715   109.25753  -129.37680
   56    52 S   CA   _C8_    47     1.45605   107.63918  -118.03404
   57    55 S   CT   _C20    64     1.42969   115.43469  -179.56885
   58    57 S   HC   _H13    65     1.09329   108.08379   178.80106
   59    57 S   HC   _H14    66     1.09426   110.31257    60.14789
   60    57 S   HC   _H15    67     1.09412   110.26306   -62.47019
   61    56 S   CA   _C7_    48     1.40076   130.73285   179.26352
   62    61 S   OM   _O39    49     1.27622   125.16870    -0.60620
   63    61 S   CA   _C6_    50     1.41737   112.36901   179.19400
   64    63 S   HA   _H6_    51     1.09287   118.26626  -179.59797
   65    63 S   CA   _C5_    52     1.41796   124.22140     0.29739
   66    65 S   CA   _C10    53     1.39384   119.56075    -0.87447
   67    66 S   HA   _H7_    54     1.08466   121.39986  -179.06686
   68    65 S   CT   _C4_    57     1.49992   120.00385  -177.96895
   69    68 S   HC   _H3_    58     1.09434   109.91863    86.14176
   70    68 S   HC   _H4_    59     1.09494   110.99093  -153.53233
   71    68 S   HC   _H5_    60     1.09482   110.90586   -34.28943
   72    56 S   CA   _C9_    55     1.38817   104.56706    -1.55557
  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
  18   2   1   1  11   5   9   6   3   4   2   1   1   8   3  10
  10   8   2   8   4   6   4   8   3   2   1   1   7   4   9   3
   7   6   2   4   2   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    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    48    49    52    54    39    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    48    49    52    53    56    72    54    50    39    42    43    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    48    49    52    54    39    42  
   40    41    46    49    39  
   42    43    44    45    40    48    49    52    54  
   41    46    47    48    49    50  
   46    47    48  
   43    44    45    49  
   44    45  
   45  
    0  
   47    48    49    52    54    50    51    55  
   48    49    50  
   49    52    53    56    72    54    50    51    55    57  
   52    53    56    61    66    72    54    50    51    55  
   51    55    57    58    59    60    52    54  
   55    57  
   53    56    61    62    63    66    72    54  
   56    61    72    54  
   56    61    65    66    67    72  
   57    58    59    60  
   61    62    63    64    65    66    67    72  
   58    59    60  
   59    60  
   60  
    0  
   62    63    64    65    66    72    68  
   63    64    65    72  
   64    65    66    67    72    68    69    70    71  
   65    66    68  
   66    67    72    68    69    70    71  
   67    72    68    69    70    71  
   72    68  
   69    70    71    72  
   70    71  
   71  
    0  
    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  -0.316400   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   0.417900   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.785200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660   0.317000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   52   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   54   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   59   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   60   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    39   320.000  1.410
   37    38   340.000  1.080
   37    40   465.000  1.376
   40    41   745.000  1.250
   40    46   465.000  1.376
   46    47   340.000  1.080
   46    48   549.000  1.340
   48    49   317.000  1.510
   48    50   320.000  1.462
   49    52   317.000  1.522
   49    54   320.000  1.410
   52    53   570.000  1.229
   52    56   310.000  1.470
   56    61   469.000  1.400
   56    72   469.000  1.400
   61    62   450.000  1.364
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   469.000  1.400
   65    68   317.000  1.510
   66    67   367.000  1.080
   66    72   469.000  1.400
   72    54   450.000  1.364
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   50    51   570.000  1.229
   50    55   214.000  1.327
   55    57   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   39    42   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    35.00000  117.00000
   33    37    40    70.00000  124.00000
   33    49    48    70.00000  112.02700
   33    49    52    63.00000  111.10000
   33    49    54    50.00000  109.50000
   33    39    42    60.00000  109.50000
   37    40    41    65.00000  137.10300
   37    40    46    70.00000  123.01800
   40    37    38    40.00000  120.50800
   40    46    47    40.00000  120.50800
   40    46    48    70.00000  117.34000
   46    40    41    65.00000  137.10300
   46    48    49    70.00000  124.00000
   46    48    50    65.00000  118.96000
   48    46    47    35.00000  120.00000
   48    49    52    70.00000  109.06800
   48    49    54    85.00000  110.90400
   48    50    51    80.00000  123.72100
   48    50    55    90.00000  111.29400
   49    33    37    70.00000  112.02700
   49    52    53    80.00000  120.40000
   49    52    56    65.00000  115.47100
   49    54    72    75.00000  111.00000
   52    56    61    60.00000  119.52600
   52    56    72    60.00000  119.52600
   56    52    53    75.00000  123.78400
   56    61    62    70.00000  120.00000
   56    61    63    63.00000  120.00000
   56    72    66    63.00000  120.00000
   56    72    54    70.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    70.00000  120.00000
   63    65    66    63.00000  120.00000
   63    65    68    70.00000  120.00000
   65    63    64    35.00000  120.00000
   65    66    67    35.00000  120.00000
   65    66    72    63.00000  120.00000
   65    68    69    35.00000  109.50000
   65    68    70    35.00000  109.50000
   65    68    71    35.00000  109.50000
   66    72    54    70.00000  120.00000
   72    56    61    63.00000  120.00000
   72    66    67    35.00000  120.00000
   54    49    52    90.00000  108.74100
   68    65    66    70.00000  120.00000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   50    48    49    65.00000  116.34900
   50    55    57    83.00000  116.90000
   55    50    51    83.00000  123.40000
   55    57    58    35.00000  109.50000
   55    57    59    35.00000  109.50000
   55    57    60    35.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   39    33    37    85.00000  110.90400
   39    33    49    50.00000  109.50000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    49    48   0.56750  1.0 1.0
   29    33    49    48  -0.07550 -1.0 2.0
   29    33    49    48   0.20000  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    49    54   0.56750  1.0 1.0
   29    33    49    54  -0.07550 -1.0 2.0
   29    33    49    54   0.20000  1.0 3.0
   29    33    39    42   0.14700  1.0 1.0
   29    33    39    42  -1.16150 -1.0 2.0
   29    33    39    42   0.48700  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    46   7.00000 -1.0 2.0
   33    49    52    53   0.30150 -1.0 2.0
   33    49    52    56   0.05850 -1.0 2.0
   33    49    52    56   0.17250  1.0 3.0
   33    49    54    72  -0.32850  1.0 1.0
   33    49    54    72  -0.35800 -1.0 2.0
   33    49    54    72   0.33950  1.0 3.0
   33    39    42    43   0.37050  1.0 3.0
   33    39    42    44   0.37050  1.0 3.0
   33    39    42    45   0.37050  1.0 3.0
   37    33    49    48   0.31000  1.0 1.0
   37    33    49    48   0.14700 -1.0 2.0
   37    33    49    48   0.07550  1.0 3.0
   37    33    49    52  -0.98800  1.0 1.0
   37    33    49    52   0.48800 -1.0 2.0
   37    33    49    52   0.76800  1.0 3.0
   37    33    49    54   0.61850  1.0 1.0
   37    33    49    54  -0.22750 -1.0 2.0
   37    33    49    54   0.15300  1.0 3.0
   37    33    39    42  -0.77900  1.0 1.0
   37    33    39    42  -0.36900 -1.0 2.0
   37    33    39    42   0.40400  1.0 3.0
   37    40    46    47   7.00000 -1.0 2.0
   37    40   -46    48   7.00000 -1.0 2.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    46   7.00000 -1.0 2.0
   40    46    48    49   7.00000 -1.0 2.0
   40    46    48    50   7.00000 -1.0 2.0
   41    40    46    47   7.00000 -1.0 2.0
   41    40    46    48   7.00000 -1.0 2.0
   46    48   -49    33   0.09850  1.0 1.0
   46    48   -49    33   0.15250 -1.0 2.0
   46    48   -49    33  -0.50650  1.0 3.0
   46    48    49    52  -0.51250  1.0 1.0
   46    48    49    52  -0.88800 -1.0 2.0
   46    48    49    52   0.08850  1.0 3.0
   46    48    49    54   0.39000  1.0 1.0
   46    48    49    54  -0.05800 -1.0 2.0
   46    48    49    54  -0.55150  1.0 3.0
   46    48    50    51   1.00000 -1.0 2.0
   46    48    50    55  -0.56150  1.0 1.0
   46    48    50    55   2.19150 -1.0 2.0
   47    46    48    49   7.00000 -1.0 2.0
   47    46    48    50   7.00000 -1.0 2.0
   48    49    52    53   0.30150 -1.0 2.0
   48    49    52    56   0.65300  1.0 1.0
   48    49    52    56  -0.03850 -1.0 2.0
   48    49    52    56   0.33900  1.0 3.0
   48    49    54    72  -0.25600  1.0 1.0
   48    49    54    72  -0.40050 -1.0 2.0
   48    49    54    72   0.34700  1.0 3.0
   48    50    55    57   2.00000 -1.0 2.0
   49    33    37    38   0.00000  1.0 1.0
   49    33   -37    40   0.09850  1.0 1.0
   49    33   -37    40   0.15250 -1.0 2.0
   49    33   -37    40  -0.50650  1.0 3.0
   49    33    39    42   0.06250  1.0 1.0
   49    33    39    42  -0.01100 -1.0 2.0
   49    33    39    42   0.28050  1.0 3.0
   49    48    50    51  -0.64400  1.0 1.0
   49    48    50    51   0.26850 -1.0 2.0
   49    48    50    55  -0.15000  1.0 1.0
   49    48    50    55   0.89550 -1.0 2.0
   49    48    50    55  -0.06900  1.0 3.0
   49    52    56    61   2.26350  1.0 1.0
   49    52    56    61   0.76750 -1.0 2.0
   49    52    56    61   0.22500  1.0 3.0
   49    52   -56    72   2.26350  1.0 1.0
   49    52   -56    72   0.76750 -1.0 2.0
   49    52   -56    72   0.22500  1.0 3.0
   52    49   -54    72  -0.25600  1.0 1.0
   52    49   -54    72  -0.40050 -1.0 2.0
   52    49   -54    72   0.34700  1.0 3.0
   52    56    61    62   3.62500 -1.0 2.0
   52    56    61    63   3.62500 -1.0 2.0
   52    56    72    66   3.62500 -1.0 2.0
   52    56   -72    54   3.62500 -1.0 2.0
   53    52    56    61   1.05000 -1.0 2.0
   53    52    56    72   1.05000 -1.0 2.0
   56    61    63    64   3.62500 -1.0 2.0
   56    61    63    65   3.62500 -1.0 2.0
   56    72   -54    49   1.63200 -1.0 2.0
   61    56    72    66   3.62500 -1.0 2.0
   61    56    72    54   3.62500 -1.0 2.0
   61    63   -65    66   3.62500 -1.0 2.0
   61    63    65    68   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   63    65    66    67   3.62500 -1.0 2.0
   63    65    66    72   3.62500 -1.0 2.0
   63    65    68    69   0.00000  1.0 1.0
   63    65    68    70   0.00000  1.0 1.0
   63    65    68    71   0.00000  1.0 1.0
   64    63    65    66   3.62500 -1.0 2.0
   64    63    65    68   3.62500 -1.0 2.0
   65    66   -72    56   3.62500 -1.0 2.0
   65    66    72    54   3.62500 -1.0 2.0
   66    65    68    69   0.00000  1.0 1.0
   66    65    68    70   0.00000  1.0 1.0
   66    65    68    71   0.00000  1.0 1.0
   66    72    54    49   1.63200 -1.0 2.0
   67    66    72    56   3.62500 -1.0 2.0
   67    66    72    54   3.62500 -1.0 2.0
   72    56    61    62   3.62500 -1.0 2.0
   72    56   -61    63   3.62500 -1.0 2.0
   54    49    52    53   0.30150 -1.0 2.0
   54    49   -52    56   0.65300  1.0 1.0
   54    49   -52    56  -0.03850 -1.0 2.0
   54    49   -52    56   0.33900  1.0 3.0
   68    65    66    67   3.62500 -1.0 2.0
   68    65    66    72   3.62500 -1.0 2.0
   50    48    49    33   0.09700  1.0 1.0
   50    48    49    33   0.15600 -1.0 2.0
   50    48    49    33  -0.50800  1.0 3.0
   50    48    49    52   0.09700  1.0 1.0
   50    48    49    52   0.15600 -1.0 2.0
   50    48    49    52  -0.50800  1.0 3.0
   50    48    49    54   0.09700  1.0 1.0
   50    48    49    54   0.15600 -1.0 2.0
   50    48    49    54  -0.50800  1.0 3.0
   50    55    57    58   0.08050  1.0 3.0
   50    55    57    59   0.08050  1.0 3.0
   50    55    57    60   0.08050  1.0 3.0
   51    50    55    57   3.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    40   0.39000  1.0 1.0
   39    33    37    40  -0.05800 -1.0 2.0
   39    33    37    40  -0.55150  1.0 3.0
   39    33    49    48   0.61850  1.0 1.0
   39    33    49    48  -0.22750 -1.0 2.0
   39    33    49    48   0.15300  1.0 3.0
   39    33    49    52  -0.09450  1.0 1.0
   39    33    49    52  -1.12950 -1.0 2.0
   39    33    49    52   0.54000  1.0 3.0
   39    33    49    54   1.11900  1.0 1.0
   39    33    49    54  -1.16350 -1.0 2.0
   39    33    49    54  -0.34150  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
   33    38    37    40   1.10000 -1.0 2.0
   46    41    40    37   1.10000 -1.0 2.0
   40    47    46    48   1.10000 -1.0 2.0
   50    49    48    46   1.10000 -1.0 2.0
   49    56    52    53  10.50000 -1.0 2.0
   61    72    56    52   4.00000 -1.0 2.0
   63    62    61    56   4.00000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   66    68    65    63   4.00000 -1.0 2.0
   72    67    66    65   1.10000 -1.0 2.0
   66    54    72    56   4.00000 -1.0 2.0
   48    55    50    51  10.50000 -1.0 2.0
END
