* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    126    213     376
    1     0 S   NP   _N1_     1    28.17681    98.66132   -23.88093
    2     1 S   H    _HN1     2     1.02957    62.92953    -0.23323
    3     1 S   H    _H1_     3     1.02835    45.59997   163.72512
    4     1 S   H    _H2_     4     1.02776   110.53468  -100.96366
    5     1 S   CT   _CA1     5     1.50162   136.24459    91.56762
    6     5 S   HC   _HA1     6     1.09577   105.16560   105.83333
    7     5 S   CO3  _C1_     7     1.53762   112.36180   -14.26224
    8     7 S   O2Z  _O11     8     1.26370   114.97772   -42.77842
    9     7 S   O2Z  _O12     9     1.26231   114.92770   136.12106
   10     5 S   CT   _CB1    10     1.53079   107.39780  -136.29690
   11    10 S   HC   HB11    11     1.09831   109.23438   -50.21260
   12    10 S   HC   HB12    12     1.09813   110.45967    66.31254
   13    10 S   CT   _CG1    13     1.53045   112.74687  -171.27049
   14    13 S   HC   HG11    14     1.09588   110.54485   -66.54490
   15    13 S   HC   HG12    15     1.09663   109.86259    52.67990
   16    13 S   C    _CD1    16     1.51868   112.21459   172.98345
   17    16 S   O    _OE1    17     1.22768   123.25460     3.94079
   18    16 S   N    _N2_    18     1.38587   111.83065  -175.97294
   19    18 S   H    _HN2    19     1.01569   119.03747     3.64502
   20    18 S   CT1  _CA2    20     1.45830   122.70112   176.89121
   21    20 S   HC   _HA2    21     1.09731   108.89271    26.24641
   22    20 S   C    _C2_    22     1.52932   106.89202   -90.81597
   23    22 S   O    _O2_    23     1.22974   123.00931   -29.23451
   24    20 S   CT   _CB2    32     1.53311   112.33232   149.59307
   25    24 S   HC   HB21    33     1.09430   109.64608    52.89181
   26    24 S   HC   HB22    34     1.09398   109.61332   171.79805
   27    22 S   N    _N3_    24     1.38481   112.55464   153.47332
   28    27 S   H    _HN3    25     1.01653   120.38905    -1.43668
   29    24 S   S    _SG2    35     1.82816   110.67962   -68.22481
   30    27 S   CT   _CA3    26     1.45357   122.49982   178.59250
   31    30 S   HC   HA31    27     1.09562   107.62267   -61.45766
   32    30 S   HC   HA32    28     1.09571   107.80247    54.88994
   33    29 S   CT   _C12    36     1.86807   102.33482   175.89907
   34    30 S   CO3  _C3_    29     1.52903   114.27829   176.95734
   35    34 S   O2Z  _O31    30     1.26345   116.03058     4.54610
   36    34 S   O2Z  _O32    31     1.26434   114.43318  -175.44641
   37    33 S   CO4  _C13    37     1.52670   104.76949    62.14346
   38    37 S   O    _O33    38     1.23179   121.42999    67.99195
   39    33 S   CM   _C14    54     1.56370   115.66918   179.18868
   40    37 S   CA   _C8_    39     1.48742   119.64145  -111.61917
   41    39 S   CO4  _C23    55     1.51291   112.33704  -170.24287
   42    41 S   O    _O35    56     1.22696   122.04095   -19.78789
   43    40 S   CA   _C9_    40     1.39138   121.06095    -2.72549
   44    41 S   CA   _C22    57     1.46421   119.07629   158.65188
   45    43 S   CA   _C4_    41     1.41106   120.22002  -179.95577
   46    45 S   HA   _H3_    42     1.09249   118.81295   179.93439
   47    43 S   CO4  _C10    50     1.47178   122.13362    -0.21398
   48    47 S   O    _O40    51     1.22350   122.12220   179.29947
   49    44 S   CA   _C17    58     1.37812   118.54457    21.70829
   50    45 S   CA   _C5_    43     1.41055   123.54168     0.07133
   51    50 S   OM   _O42    44     1.27628   122.81357   179.88297
   52    33 S   CO4  _C11    52     1.50991   106.09186   -63.50905
   53    52 S   O    _O39    53     1.22646   124.64560   -68.44838
   54    49 S   CA   _C18    59     1.40860   120.25878   178.66206
   55    54 S   HA   _H5_    60     1.09195   118.69784  -179.86012
   56    49 S   CO4  _C16    68     1.46822   119.64813     0.30261
   57    56 S   O    _O34    69     1.23005   118.27467   160.51435
   58    50 S   CA   _C6_    45     1.40731   114.33024    -0.06853
   59    58 S   HA   _H4_    46     1.09185   118.92744  -179.95154
   60    54 S   CA   _C19    61     1.41277   123.13381     0.46394
   61    60 S   OM   _O37    62     1.27655   122.79759   179.62675
   62    39 S   CMA  _C15    70     1.36235   128.57207    11.85860
   63    62 S   OM   _O38    71     1.26347   130.75487     1.40514
   64    40 S   CA   _C7_    47     1.39947   121.06286   177.37102
   65    60 S   CA   _C20    63     1.41040   114.45894    -0.48335
   66    65 S   HA   _H6_    64     1.09155   118.98779  -179.82417
   67    64 S   OH   _O41    48     1.37061   123.71737    -0.08393
   68    67 S   HO   _H8_    49     0.97349   108.96453     0.13988
   69    44 S   CA   _C21    65     1.39519   122.65921  -159.79525
   70    69 S   OH   _O36    66     1.36934   123.33079     1.30701
   71    70 S   HO   _H7_    67     0.97355   108.76253    -4.47107
  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
  16   2   1   1  13   5  13  12  11   4  11  12   9   4   5   2
  11   5   3   2   1   9   4   5   2   4   2   5   3   1   1   2
   4   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    52    53    39    41    62  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    43    64    47    48    52    53    39    41    42    44    56    62    63  
   35    36  
   36  
    0  
   38    40    43    45    58    64    67    47    52    53    39    41    62  
   40    43    64    52    39  
   41    42    44    49    69    56    57    62    63    40    47    52    53  
   43    45    46    50    58    59    64    67    68    47    48    52  
   42    44    49    54    65    69    70    56    62    63    52  
   44    49    69    62  
   45    46    50    51    58    64    67    47    48    52    53  
   49    54    55    60    65    66    69    70    71    56    57    62  
   46    50    51    58    59    64    47    48    52  
   50    51    58    47  
   48    52    53    50    64  
   52    53  
   54    55    60    61    65    69    70    56    57    62    63  
   51    58    59    64    67  
   58    59    64  
   53    62  
    0  
   55    60    61    65    66    69    56    57    62  
   60    61    65    56  
   57    62    63    60    69  
   62    63  
   59    64    67    68  
   64    67  
   61    65    66    69    70  
   65    66    69  
   63  
    0  
   67    68  
   66    69    70    71  
   69    70  
   68  
    0  
   70    71  
   71  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   52   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   62   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   63   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   64   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    52   317.000  1.522
   33    39   317.000  1.510
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    43   469.000  1.400
   40    64   469.000  1.400
   43    45   469.000  1.400
   43    47   310.000  1.470
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    51   450.000  1.364
   50    58   469.000  1.400
   58    59   367.000  1.080
   58    64   469.000  1.400
   64    67   450.000  1.364
   67    68   553.000  0.945
   47    48   570.000  1.229
   47    52   250.000  1.523
   52    53   570.000  1.229
   39    41   320.000  1.462
   39    62   465.000  1.376
   41    42   570.000  1.229
   41    44   310.000  1.470
   44    49   469.000  1.400
   44    69   469.000  1.400
   49    54   469.000  1.400
   49    56   310.000  1.470
   54    55   367.000  1.080
   54    60   469.000  1.400
   60    61   450.000  1.364
   60    65   469.000  1.400
   65    66   367.000  1.080
   65    69   469.000  1.400
   69    70   450.000  1.364
   70    71   553.000  0.945
   56    57   570.000  1.229
   56    62   270.000  1.476
   62    63   745.000  1.250
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  110.18000
   29    33    52    75.00000  110.18000
   29    33    39    75.00000  112.20000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    52    47    65.00000  115.45000
   33    52    53    80.00000  120.40000
   33    39    41    65.00000  116.34900
   33    39    62    70.00000  124.00000
   37    40    43    60.00000  119.52600
   37    40    64    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    43    45    63.00000  120.00000
   40    43    47    60.00000  119.52600
   40    64    58    63.00000  120.00000
   40    64    67    70.00000  120.00000
   43    45    46    35.00000  120.00000
   43    45    50    63.00000  120.00000
   43    47    48    75.00000  123.78400
   43    47    52    60.00000  117.28700
   45    50    51    70.00000  120.00000
   45    50    58    63.00000  120.00000
   50    45    46    35.00000  120.00000
   50    58    59    35.00000  120.00000
   50    58    64    63.00000  120.00000
   58    50    51    70.00000  120.00000
   58    64    67    70.00000  120.00000
   64    40    43    63.00000  120.00000
   64    58    59    35.00000  120.00000
   64    67    68    35.00000  113.00000
   47    43    45    60.00000  119.52600
   47    52    53    80.00000  119.30300
   52    33    37    75.00000  107.99600
   52    47    48    80.00000  119.30300
   39    33    37    70.00000  109.06800
   39    33    52    70.00000  109.06800
   39    41    42    80.00000  123.72100
   39    41    44    65.00000  117.02400
   39    62    56    65.00000  114.61000
   39    62    63    65.00000  137.10300
   41    44    49    60.00000  119.52600
   41    44    69    60.00000  119.52600
   44    41    42    75.00000  123.78400
   44    49    54    63.00000  120.00000
   44    49    56    60.00000  119.52600
   44    69    65    63.00000  120.00000
   44    69    70    70.00000  120.00000
   49    54    55    35.00000  120.00000
   49    54    60    63.00000  120.00000
   49    56    57    75.00000  123.78400
   49    56    62    60.00000  117.44000
   54    60    61    70.00000  120.00000
   54    60    65    63.00000  120.00000
   60    54    55    35.00000  120.00000
   60    65    66    35.00000  120.00000
   60    65    69    63.00000  120.00000
   65    60    61    70.00000  120.00000
   65    69    70    70.00000  120.00000
   69    44    49    63.00000  120.00000
   69    65    66    35.00000  120.00000
   69    70    71    35.00000  113.00000
   56    49    54    60.00000  119.52600
   56    62    63    85.00000  116.28000
   62    39    41    60.00000  125.92000
   62    56    57    80.00000  120.81000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    52    47   0.65300  1.0 1.0
   29    33    52    47  -0.03850 -1.0 2.0
   29    33    52    47   0.33900  1.0 3.0
   29    33    52    53   0.30150 -1.0 2.0
   29    33    39    41   0.09700  1.0 1.0
   29    33    39    41   0.15600 -1.0 2.0
   29    33    39    41  -0.50800  1.0 3.0
   29    33    39    62   0.42700  1.0 1.0
   29    33    39    62  -0.70350 -1.0 2.0
   29    33    39    62  -0.43150  1.0 3.0
   33    37    40    43   2.26350  1.0 1.0
   33    37    40    43   0.76750 -1.0 2.0
   33    37    40    43   0.22500  1.0 3.0
   33    37    40    64   2.26350  1.0 1.0
   33    37    40    64   0.76750 -1.0 2.0
   33    37    40    64   0.22500  1.0 3.0
   33    39    41    42  -0.64400  1.0 1.0
   33    39    41    42   0.26850 -1.0 2.0
   33    39    41    44   1.50000 -1.0 2.0
   33    39    62    56   7.00000 -1.0 2.0
   33    39    62    63   7.00000 -1.0 2.0
   37    33    52    47   0.65300  1.0 1.0
   37    33    52    47  -0.03850 -1.0 2.0
   37    33    52    47   0.33900  1.0 3.0
   37    33    52    53   0.30150 -1.0 2.0
   37    33    39    41   0.09700  1.0 1.0
   37    33    39    41   0.15600 -1.0 2.0
   37    33    39    41  -0.50800  1.0 3.0
   37    33    39    62  -0.51250  1.0 1.0
   37    33    39    62  -0.88800 -1.0 2.0
   37    33    39    62   0.08850  1.0 3.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40   -43    47   3.62500 -1.0 2.0
   37    40    64    58   3.62500 -1.0 2.0
   37    40    64    67   3.62500 -1.0 2.0
   38    37    40    43   1.05000 -1.0 2.0
   38    37    40    64   1.05000 -1.0 2.0
   40    43    45    46   3.62500 -1.0 2.0
   40    43    45    50   3.62500 -1.0 2.0
   40    43    47    48   1.05000 -1.0 2.0
   40    43    47    52   0.56600 -1.0 2.0
   40    64    67    68   0.84100 -1.0 2.0
   43    40    64    58   3.62500 -1.0 2.0
   43    40    64    67   3.62500 -1.0 2.0
   43    45    50    51   3.62500 -1.0 2.0
   43    45   -50    58   3.62500 -1.0 2.0
   43    47   -52    33   0.43900  1.0 1.0
   43    47   -52    33  -0.18150 -1.0 2.0
   43    47   -52    33  -0.03650  1.0 3.0
   43    47    52    53   0.03000  1.0 1.0
   43    47    52    53   0.58800 -1.0 2.0
   43    47    52    53   0.15550  1.0 3.0
   45    43    47    48   1.05000 -1.0 2.0
   45    43    47    52   0.56600 -1.0 2.0
   45    50    58    59   3.62500 -1.0 2.0
   45    50    58    64   3.62500 -1.0 2.0
   46    45    50    51   3.62500 -1.0 2.0
   46    45    50    58   3.62500 -1.0 2.0
   50    58   -64    40   3.62500 -1.0 2.0
   50    58    64    67   3.62500 -1.0 2.0
   51    50    58    59   3.62500 -1.0 2.0
   51    50    58    64   3.62500 -1.0 2.0
   58    64    67    68   0.84100 -1.0 2.0
   59    58    64    40   3.62500 -1.0 2.0
   59    58    64    67   3.62500 -1.0 2.0
   64    40   -43    45   3.62500 -1.0 2.0
   64    40    43    47   3.62500 -1.0 2.0
   47    43    45    46   3.62500 -1.0 2.0
   47    43    45    50   3.62500 -1.0 2.0
   48    47    52    33   0.49600 -1.0 2.0
   48    47    52    53   0.06100 -1.0 2.0
   52    33    37    38   0.30150 -1.0 2.0
   52    33   -37    40   0.65300  1.0 1.0
   52    33   -37    40  -0.03850 -1.0 2.0
   52    33   -37    40   0.33900  1.0 3.0
   52    33    39    41   0.09700  1.0 1.0
   52    33    39    41   0.15600 -1.0 2.0
   52    33    39    41  -0.50800  1.0 3.0
   52    33    39    62  -0.51250  1.0 1.0
   52    33    39    62  -0.88800 -1.0 2.0
   52    33    39    62   0.08850  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    52    47   0.65300  1.0 1.0
   39    33    52    47  -0.03850 -1.0 2.0
   39    33    52    47   0.33900  1.0 3.0
   39    33    52    53   0.30150 -1.0 2.0
   39    41    44    49  -0.11500  1.0 1.0
   39    41    44    49   1.10450 -1.0 2.0
   39    41    44    49  -0.48050  1.0 3.0
   39    41    44    69  -0.11500  1.0 1.0
   39    41    44    69   1.10450 -1.0 2.0
   39    41    44    69  -0.48050  1.0 3.0
   41    39    62    56   7.00000 -1.0 2.0
   41    39    62    63   7.00000 -1.0 2.0
   41    44    49    54   3.62500 -1.0 2.0
   41    44   -49    56   3.62500 -1.0 2.0
   41    44    69    65   3.62500 -1.0 2.0
   41    44    69    70   3.62500 -1.0 2.0
   42    41    44    49   1.05000 -1.0 2.0
   42    41    44    69   1.05000 -1.0 2.0
   44    49    54    55   3.62500 -1.0 2.0
   44    49    54    60   3.62500 -1.0 2.0
   44    49    56    57   1.05000 -1.0 2.0
   44    49    56    62  -0.11500  1.0 1.0
   44    49    56    62   1.10450 -1.0 2.0
   44    49    56    62  -0.48050  1.0 3.0
   44    69    70    71   0.84100 -1.0 2.0
   49    44    69    65   3.62500 -1.0 2.0
   49    44    69    70   3.62500 -1.0 2.0
   49    54    60    61   3.62500 -1.0 2.0
   49    54   -60    65   3.62500 -1.0 2.0
   49    56   -62    39  -1.65800  1.0 1.0
   49    56   -62    39   0.77650 -1.0 2.0
   49    56    62    63   1.50000 -1.0 2.0
   54    49    56    57   1.05000 -1.0 2.0
   54    49    56    62  -0.11500  1.0 1.0
   54    49    56    62   1.10450 -1.0 2.0
   54    49    56    62  -0.48050  1.0 3.0
   54    60    65    66   3.62500 -1.0 2.0
   54    60    65    69   3.62500 -1.0 2.0
   55    54    60    61   3.62500 -1.0 2.0
   55    54    60    65   3.62500 -1.0 2.0
   60    65   -69    44   3.62500 -1.0 2.0
   60    65    69    70   3.62500 -1.0 2.0
   61    60    65    66   3.62500 -1.0 2.0
   61    60    65    69   3.62500 -1.0 2.0
   65    69    70    71   0.84100 -1.0 2.0
   66    65    69    44   3.62500 -1.0 2.0
   66    65    69    70   3.62500 -1.0 2.0
   69    44   -49    54   3.62500 -1.0 2.0
   69    44    49    56   3.62500 -1.0 2.0
   56    49    54    55   3.62500 -1.0 2.0
   56    49    54    60   3.62500 -1.0 2.0
   57    56    62    39   1.00000 -1.0 2.0
   57    56    62    63  -0.11900  1.0 1.0
   57    56    62    63   0.76850 -1.0 2.0
   57    56    62    63   0.14100  1.0 3.0
   62    39    41    42   1.00000 -1.0 2.0
   62    39   -41    44  -1.65800  1.0 1.0
   62    39   -41    44   0.77650 -1.0 2.0
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    40    37    38  10.50000 -1.0 2.0
   43    64    40    37   4.00000 -1.0 2.0
   45    47    43    40   4.00000 -1.0 2.0
   50    46    45    43   1.10000 -1.0 2.0
   58    51    50    45   4.00000 -1.0 2.0
   64    59    58    50   1.10000 -1.0 2.0
   58    67    64    40   4.00000 -1.0 2.0
   43    52    47    48  10.50000 -1.0 2.0
   33    47    52    53  10.50000 -1.0 2.0
   33    41    39    62   1.10000 -1.0 2.0
   39    44    41    42  10.50000 -1.0 2.0
   49    69    44    41   4.00000 -1.0 2.0
   54    56    49    44   4.00000 -1.0 2.0
   60    55    54    49   1.10000 -1.0 2.0
   65    61    60    54   4.00000 -1.0 2.0
   69    66    65    60   1.10000 -1.0 2.0
   65    70    69    44   4.00000 -1.0 2.0
   49    62    56    57  10.50000 -1.0 2.0
   56    63    62    39   1.10000 -1.0 2.0
END
