* LIGAND DATABASE FILE (OPLS2005)
*
001      69    70    122    189     357
    1     0 S   NP   _N1_     1    28.87899    93.07635   -21.25677
    2     1 S   H    _HN1     2     1.02952    94.33131    21.89550
    3     1 S   H    _H1_     3     1.02830    24.05864   145.13028
    4     1 S   H    _H2_     4     1.02774    93.61761   -86.86882
    5     1 S   CT   _CA1     5     1.50185   134.75702   146.37863
    6     5 S   HC   _HA1     6     1.09574   105.14513    58.62298
    7     5 S   CO3  _C1_     7     1.53795   112.54480   -61.35428
    8     7 S   O2Z  _O11     8     1.26361   114.99582   -36.85619
    9     7 S   O2Z  _O12     9     1.26240   114.98338   142.18779
   10     5 S   CT   _CB1    10     1.53086   107.35764   176.53112
   11    10 S   HC   HB11    11     1.09823   109.22130   -49.47351
   12    10 S   HC   HB12    12     1.09826   110.38571    67.02772
   13    10 S   CT   _CG1    13     1.53040   112.85380  -170.61196
   14    13 S   HC   HG11    14     1.09588   110.35394   -65.77819
   15    13 S   HC   HG12    15     1.09644   110.08747    53.53899
   16    13 S   C    _CD1    16     1.51801   112.26494   173.75458
   17    16 S   O    _OE1    17     1.22726   123.24584    -3.95468
   18    16 S   N    _N2_    18     1.38675   111.80312   176.29356
   19    18 S   H    _HN2    19     1.01590   119.15555     1.18134
   20    18 S   CT1  _CA2    20     1.46115   123.05347  -178.37900
   21    20 S   HC   _HA2    21     1.09578   109.06811   -12.11966
   22    20 S   C    _C2_    22     1.53365   108.89055  -127.36252
   23    22 S   O    _O2_    23     1.23030   122.10987  -147.71646
   24    20 S   CT   _CB2    32     1.53488   111.72717   110.09061
   25    24 S   HC   HB21    33     1.09657   109.46473    61.79549
   26    24 S   HC   HB22    34     1.09501   111.06406   179.09453
   27    22 S   N    _N3_    24     1.38471   113.46084    39.92270
   28    27 S   H    _HN3    25     1.01521   118.94866    -0.77025
   29    24 S   S    _SG2    35     1.82829   114.06401   -57.39618
   30    27 S   CT   _CA3    26     1.45432   123.31257   174.59528
   31    30 S   HC   HA31    27     1.09532   109.08615    27.65280
   32    30 S   HC   HA32    28     1.09490   107.18140   144.66543
   33    29 S   CT   _C6_    36     1.83632   100.39349   -74.12705
   34    33 S   HC   _H4_    37     1.09390   109.61951    39.46412
   35    30 S   CO3  _C3_    29     1.52941   113.13941   -95.68252
   36    35 S   O2Z  _O31    30     1.26399   115.42642   -43.92931
   37    35 S   O2Z  _O32    31     1.26355   114.96670   136.94958
   38    33 S   CO4  _C7_    38     1.51628   106.77250   154.14789
   39    38 S   O    _O34    39     1.23150   120.70531   -96.67152
   40    38 S   CM   _C8_    40     1.50033   118.84856    80.54634
   41    40 S   CM   _C9_    41     1.34128   118.14135    20.06022
   42    41 S   HC   _H9_    42     1.08478   121.80111  -179.44786
   43    40 S   CT   _C11    52     1.52891   115.84445  -159.91355
   44    43 S   HC   _H5_    53     1.10045   105.81115   -50.07843
   45    41 S   CO4  _C10    43     1.48222   123.45321     1.09843
   46    45 S   O    _O35    44     1.23109   119.11035   179.60435
   47    43 S   CA   _C14    54     1.52822   111.40824    66.60689
   48    43 S   CM   _C12    65     1.51696   114.52832  -166.96389
   49    48 S   HC   _H10    66     1.08824   118.03075   -68.44996
   50    33 S   CT   _C5_    45     1.52374   112.02799   -83.40684
   51    50 S   HC   _H3_    46     1.09749   111.49159    44.53675
   52    47 S   CA   _C15    55     1.40399   119.96383  -120.61605
   53    52 S   HA   _H13    56     1.08728   120.45177    -0.58617
   54    48 S   CM   _C13    67     1.33919   124.08248   112.08447
   55    54 S   HC   _H11    68     1.08481   120.45038   179.71333
   56    54 S   HC   _H12    69     1.08455   121.70033    -0.27836
   57    50 S   OS   _O33    47     1.43142   110.30465   167.01008
   58    52 S   CA   _C16    57     1.39585   120.63102   178.71732
   59    58 S   HA   _H14    58     1.08632   120.01838  -179.47140
   60    57 S   CT   _C4_    48     1.42218   112.81478   -89.95635
   61    60 S   HC   _H6_    49     1.09326   108.24714   178.01821
   62    60 S   HC   _H7_    50     1.09360   111.08599    58.90332
   63    60 S   HC   _H8_    51     1.09423   110.29495   -63.44274
   64    58 S   CA   _C17    59     1.39302   120.11998     0.20936
   65    64 S   HA   _H15    60     1.08641   119.95997  -179.67857
   66    64 S   CA   _C18    61     1.39268   119.94662     0.18023
   67    66 S   HA   _H16    62     1.08622   119.95922  -180.00000
   68    47 S   CA   _C19    63     1.40540   121.45612    58.65943
   69    68 S   HA   _H17    64     1.08716   120.59648     0.84326
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  12   7   2   1   1  12   4  13  10   4  14   6   5   3  12   6
   3   6   2   8   4   2   1   1   4   6   3   3   2   1   1   5
   3   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    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    50    51    57  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    46    50    51    57    60    43  
   38    39    40    45    50    51    57  
   36    37  
   37  
    0  
   39    40    41    42    45    50    51    57    43    44    47    48  
   40    41    50    43  
   41    42    45    46    50    43    44    47    52    68    48    49    54  
   42    45    46    50    51    57    43    44    47    48  
   45    46    50    43  
   44    47    52    53    58    66    68    69    48    49    54    55    56    45  
   47    52    68    48    49    54  
   46    50    51    57    60  
   50    51    57  
   52    53    58    59    64    66    67    68    69    48    49    54  
   49    54    55    56    52    68  
   54    55    56  
   51    57    60    61    62    63  
   57    60  
   53    58    59    64    65    66    68    69  
   58    59    64    68  
   55    56  
   56  
    0  
   60    61    62    63  
   59    64    65    66    67    68  
   64    65    66  
   61    62    63  
   62    63  
   63  
    0  
   65    66    67    68    69  
   66    67    68  
   67    68    69  
   68    69  
   69  
    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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   317.000  1.522
   33    50   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   549.000  1.340
   40    43   317.000  1.510
   41    42   340.000  1.080
   41    45   320.000  1.462
   45    46   570.000  1.229
   45    50   317.000  1.522
   50    51   340.000  1.090
   50    57   320.000  1.410
   57    60   320.000  1.410
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   43    44   340.000  1.090
   43    47   317.000  1.510
   43    48   317.000  1.510
   47    52   469.000  1.400
   47    68   469.000  1.400
   52    53   367.000  1.080
   52    58   469.000  1.400
   58    59   367.000  1.080
   58    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   48    49   340.000  1.080
   48    54   549.000  1.340
   54    55   340.000  1.080
   54    56   340.000  1.080
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  110.18000
   29    33    50    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    50    45    63.00000  111.10000
   33    50    51    37.50000  110.70000
   33    50    57    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  118.96000
   38    40    43    65.00000  116.34900
   40    38    39    80.00000  123.72100
   40    41    42    35.00000  120.00000
   40    41    45    65.00000  118.96000
   40    43    44    35.00000  109.50000
   40    43    47    70.00000  112.99600
   40    43    48    70.00000  110.12100
   41    45    46    80.00000  123.72100
   41    45    50    65.00000  118.62400
   45    41    42    40.00000  117.72500
   45    50    51    35.00000  109.50000
   45    50    57    90.00000  108.74100
   50    33    34    37.50000  110.70000
   50    33    38    63.00000  111.10000
   50    45    46    80.00000  120.40000
   50    57    60    60.00000  109.50000
   57    50    51    35.00000  109.50000
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   43    40    41    70.00000  124.00000
   43    47    52    70.00000  120.00000
   43    47    68    70.00000  120.00000
   43    48    49    35.00000  117.00000
   43    48    54    70.00000  124.00000
   47    43    44    35.00000  109.50000
   47    52    53    35.00000  120.00000
   47    52    58    63.00000  120.00000
   47    68    66    63.00000  120.00000
   47    68    69    35.00000  120.00000
   52    58    59    35.00000  120.00000
   52    58    64    63.00000  120.00000
   58    52    53    35.00000  120.00000
   58    64    65    35.00000  120.00000
   58    64    66    63.00000  120.00000
   64    58    59    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  120.00000
   68    47    52    63.00000  120.00000
   68    66    67    35.00000  120.00000
   48    43    44    35.00000  109.50000
   48    43    47    70.00000  112.99600
   48    54    55    35.00000  120.00000
   48    54    56    35.00000  120.00000
   54    48    49    35.00000  120.00000
   56    54    55    35.00000  117.00000
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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    50    45   0.56750  1.0 1.0
   29    33    50    45  -0.07550 -1.0 2.0
   29    33    50    45   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    57   0.56750  1.0 1.0
   29    33    50    57  -0.07550 -1.0 2.0
   29    33    50    57   0.20000  1.0 3.0
   33    38    40    41  -0.33500  1.0 1.0
   33    38    40    41   1.06600 -1.0 2.0
   33    38    40    41  -0.14000  1.0 3.0
   33    38    40    43   0.25700  1.0 1.0
   33    38    40    43   0.66200 -1.0 2.0
   33    38    40    43   0.04450  1.0 3.0
   33    50    57    60   0.06250  1.0 1.0
   33    50    57    60  -0.01100 -1.0 2.0
   33    50    57    60   0.28050  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    50    45  -0.11250  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    57   0.23400  1.0 3.0
   38    33    50    45   0.11950  1.0 1.0
   38    33    50    45   0.20300 -1.0 2.0
   38    33    50    45  -0.70800  1.0 3.0
   38    33    50    51  -0.11250  1.0 3.0
   38    33    50    57  -0.09450  1.0 1.0
   38    33    50    57  -1.12950 -1.0 2.0
   38    33    50    57   0.54000  1.0 3.0
   38    40    41    42   7.00000 -1.0 2.0
   38    40   -41    45   7.00000 -1.0 2.0
   38    40    43    44   0.15000  1.0 3.0
   38    40    43    47   0.09700  1.0 1.0
   38    40    43    47   0.15600 -1.0 2.0
   38    40    43    47  -0.50800  1.0 3.0
   38    40    43    48   0.09700  1.0 1.0
   38    40    43    48   0.15600 -1.0 2.0
   38    40    43    48  -0.50800  1.0 3.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    43  -0.64400  1.0 1.0
   39    38    40    43   0.26850 -1.0 2.0
   40    41    45    46   1.00000 -1.0 2.0
   40    41    45    50  -0.33500  1.0 1.0
   40    41    45    50   1.06600 -1.0 2.0
   40    41    45    50  -0.14000  1.0 3.0
   40    43    47    52   0.18050 -1.0 2.0
   40    43    47    68   0.18050 -1.0 2.0
   40    43    48    49   0.00000  1.0 1.0
   40    43    48    54  -0.28300  1.0 1.0
   40    43    48    54   0.26700 -1.0 2.0
   40    43    48    54  -0.63300  1.0 3.0
   41    40    43    44   0.00000  1.0 1.0
   41    40    43    47   1.44450  1.0 1.0
   41    40    43    47   0.06600 -1.0 2.0
   41    40    43    47   0.29250  1.0 3.0
   41    40    43    48  -0.28300  1.0 1.0
   41    40    43    48   0.26700 -1.0 2.0
   41    40    43    48  -0.63300  1.0 3.0
   41    45   -50    33   0.65300  1.0 1.0
   41    45   -50    33  -0.03850 -1.0 2.0
   41    45   -50    33   0.33900  1.0 3.0
   41    45    50    51   0.00000  1.0 1.0
   41    45    50    57   0.65300  1.0 1.0
   41    45    50    57  -0.03850 -1.0 2.0
   41    45    50    57   0.33900  1.0 3.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    50   0.04550  1.0 1.0
   42    41    45    50   0.83000 -1.0 2.0
   42    41    45    50  -0.04000  1.0 3.0
   45    50    57    60  -1.11000  1.0 1.0
   45    50    57    60   0.50250 -1.0 2.0
   45    50    57    60   0.47450  1.0 3.0
   46    45    50    33   0.30150 -1.0 2.0
   46    45    50    51   0.00000  1.0 1.0
   46    45    50    57   0.30150 -1.0 2.0
   50    33    38    39   0.30150 -1.0 2.0
   50    33   -38    40   0.65300  1.0 1.0
   50    33   -38    40  -0.03850 -1.0 2.0
   50    33   -38    40   0.33900  1.0 3.0
   50    57    60    61   0.37050  1.0 3.0
   50    57    60    62   0.37050  1.0 3.0
   50    57    60    63   0.37050  1.0 3.0
   51    50    57    60   0.37050  1.0 3.0
   43    40    41    42   7.00000 -1.0 2.0
   43    40    41    45   7.00000 -1.0 2.0
   43    47    52    53   3.62500 -1.0 2.0
   43    47    52    58   3.62500 -1.0 2.0
   43    47    68    66   3.62500 -1.0 2.0
   43    47    68    69   3.62500 -1.0 2.0
   43    48    54    55   7.00000 -1.0 2.0
   43    48    54    56   7.00000 -1.0 2.0
   44    43    47    52   0.00000  1.0 1.0
   44    43    47    68   0.00000  1.0 1.0
   44    43    48    49   0.33100  1.0 3.0
   44    43    48    54   0.00000  1.0 1.0
   47    43    48    49   0.00000  1.0 1.0
   47    43    48    54   1.44450  1.0 1.0
   47    43    48    54   0.06600 -1.0 2.0
   47    43    48    54   0.29250  1.0 3.0
   47    52    58    59   3.62500 -1.0 2.0
   47    52    58    64   3.62500 -1.0 2.0
   52    47    68    66   3.62500 -1.0 2.0
   52    47    68    69   3.62500 -1.0 2.0
   52    58    64    65   3.62500 -1.0 2.0
   52    58   -64    66   3.62500 -1.0 2.0
   53    52    58    59   3.62500 -1.0 2.0
   53    52    58    64   3.62500 -1.0 2.0
   58    64    66    67   3.62500 -1.0 2.0
   58    64    66    68   3.62500 -1.0 2.0
   59    58    64    65   3.62500 -1.0 2.0
   59    58    64    66   3.62500 -1.0 2.0
   64    66   -68    47   3.62500 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   67    66    68    47   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   68    47    52    53   3.62500 -1.0 2.0
   68    47   -52    58   3.62500 -1.0 2.0
   48    43    47    52   0.18050 -1.0 2.0
   48    43    47    68   0.18050 -1.0 2.0
   49    48    54    55   7.00000 -1.0 2.0
   49    48    54    56   7.00000 -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
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39  10.50000 -1.0 2.0
   38    43    40    41   1.10000 -1.0 2.0
   45    42    41    40   1.10000 -1.0 2.0
   41    50    45    46  10.50000 -1.0 2.0
   52    68    47    43   4.00000 -1.0 2.0
   58    53    52    47   1.10000 -1.0 2.0
   64    59    58    52   1.10000 -1.0 2.0
   66    65    64    58   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   66    69    68    47   1.10000 -1.0 2.0
   43    49    48    54  15.00000 -1.0 2.0
   55    56    54    48  15.00000 -1.0 2.0
END
