* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    125    197     364
    1     0 S   NP   _N1_     1    27.95202    96.92637   -21.32692
    2     1 S   H    _HN1     2     1.02958    75.59853   -11.13535
    3     1 S   H    _H1_     3     1.02836    39.11495   131.56850
    4     1 S   H    _H2_     4     1.02775    96.84464  -118.37796
    5     1 S   CT   _CA1     5     1.50139   145.35505    93.97924
    6     5 S   HC   _HA1     6     1.09575   105.20808    83.46489
    7     5 S   CO3  _C1_     7     1.53781   112.35351   -36.70534
    8     7 S   O2Z  _O11     8     1.26365   114.98713   -43.83588
    9     7 S   O2Z  _O12     9     1.26234   114.93393   135.22129
   10     5 S   CT   _CB1    10     1.53098   107.42034  -158.63876
   11    10 S   HC   HB11    11     1.09827   109.31248   -50.54710
   12    10 S   HC   HB12    12     1.09815   110.43729    66.00561
   13    10 S   CT   _CG1    13     1.53018   112.67699  -171.62047
   14    13 S   HC   HG11    14     1.09596   110.48540   -64.70396
   15    13 S   HC   HG12    15     1.09658   109.91645    54.48989
   16    13 S   C    _CD1    16     1.51845   112.32465   174.84649
   17    16 S   O    _OE1    17     1.22755   123.28920     0.45413
   18    16 S   N    _N2_    18     1.38530   111.69558  -179.42768
   19    18 S   H    _HN2    19     1.01552   119.11785     3.74763
   20    18 S   CT1  _CA2    20     1.45862   122.91624   178.46176
   21    20 S   HC   _HA2    21     1.09741   108.83838    25.96068
   22    20 S   C    _C2_    22     1.52924   107.04593   -91.09491
   23    22 S   O    _O2_    23     1.22986   123.06001   -27.78622
   24    20 S   CT   _CB2    32     1.53347   112.20634   149.15142
   25    24 S   HC   HB21    33     1.09386   109.42304    53.62631
   26    24 S   HC   HB22    34     1.09418   109.60420   172.54441
   27    22 S   N    _N3_    24     1.38513   112.56215   154.84485
   28    27 S   H    _HN3    25     1.01664   120.29255    -1.49920
   29    24 S   S    _SG2    35     1.82861   110.39669   -66.73875
   30    27 S   CT   _CA3    26     1.45343   122.48552   178.68985
   31    30 S   HC   HA31    27     1.09567   107.67363   -58.65912
   32    30 S   HC   HA32    28     1.09565   107.72575    57.65047
   33    29 S   CT   _C12    36     1.89284   103.00815  -174.25871
   34    33 S   OM   _O36    37     1.32289   110.77451    53.08356
   35    30 S   CO3  _C3_    29     1.52891   114.37046   179.51463
   36    35 S   O2Z  _O31    30     1.26332   116.08829    -0.57878
   37    35 S   O2Z  _O32    31     1.26447   114.40179   179.43525
   38    33 S   CA   _C13    38     1.54726   108.35725   -67.60094
   39    33 S   CM   _C5_    52     1.56214   105.99799   168.16933
   40    38 S   CA   _C14    39     1.41411   122.30962    88.15534
   41    40 S   HA   _H11    40     1.08839   120.61298     2.26175
   42    39 S   CMA  _C6_    53     1.37654   128.87471   -61.25131
   43    42 S   OM   _O33    54     1.26634   129.60660   179.71401
   44    40 S   CA   _C15    41     1.39922   122.00317  -177.05643
   45    44 S   HA   _H12    42     1.08630   119.78226   179.89532
   46    42 S   NE   _N5_    55     1.40227   118.46538    -3.23573
   47    46 S   H    _H6_    56     1.01757   112.98467    -7.81062
   48    44 S   CA   _C16    43     1.38974   120.16664     0.18345
   49    48 S   HA   _H13    44     1.08584   120.16129   179.98022
   50    46 S   CA   _C7_    57     1.42238   132.21080   155.44366
   51    48 S   CA   _C17    45     1.38980   119.65333    -0.25334
   52    51 S   HA   _H14    46     1.08623   119.12761  -179.52399
   53    50 S   CA   _C8_    58     1.40042   116.63860   165.46220
   54    53 S   HA   _H7_    59     1.08657   120.75646     0.55461
   55    38 S   CA   _C18    47     1.40530   121.80942   -88.46600
   56    53 S   CA   _C9_    60     1.39331   119.76931  -179.42665
   57    56 S   HA   _H8_    61     1.08571   120.08602  -179.83449
   58    55 S   SY   _S1_    48     1.75993   118.86476    -6.91390
   59    58 S   OY   _O34    49     1.44947   106.83697    80.34698
   60    58 S   OY   _O35    50     1.45174   107.68524  -148.93171
   61    56 S   CA   _C10    62     1.38577   119.57869     0.25641
   62    61 S   HA   _H9_    63     1.08344   121.23172   179.96574
   63    58 S   NS   _N4_    51     1.71458   100.41066   -35.47080
   64    61 S   CA   _C11    64     1.38159   117.57082     0.07913
   65    64 S   HA   _H10    65     1.08504   120.91777   179.83214
   66    50 S   NB   _N6_    66     1.35778   122.75069   -13.35908
   67    63 S   CT   _C4_    67     1.49160   116.37421   -74.01315
   68    67 S   HC   _H3_    68     1.09395   109.81051   -58.99987
   69    67 S   HC   _H4_    69     1.09464   110.68275  -177.02876
   70    67 S   HC   _H5_    70     1.09356   111.39447    62.44988
  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   8   5   4   3
  14   6   2   1   1  14  15   8   4   9   4   6   3   8   3   5
   3   8   6   2   7   4   5   6   3   7   3   2   4   3   4   2
   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    55    63    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    51    55    58    63    39    42    43    46    67  
   38    40    55    63    39    42  
   36    37  
   37  
    0  
   40    41    44    45    48    51    52    55    58    59    60    63    39    42  
   42    43    46    47    50    67    68    69    70    40    55    58    59    60    63  
   41    44    45    48    49    51    55    58  
   44    45    48    55  
   43    46    47    50    53    66    67    58    63  
   46    47    50    63  
   45    48    49    51    52    55  
   48    49    51  
   47    50    53    54    56    64    66    63  
   50    53    66  
   49    51    52    55    58  
   51    52    55  
   53    54    56    57    61    64    65    66  
   52    55    58    59    60    63  
   55    58  
   54    56    57    61    62    64    66  
   56    57    61    66  
   58    59    60    63    67  
   57    61    62    64    65    66  
   61    62    64  
   59    60    63    67    68    69    70  
   60    63    67  
   63    67  
   62    64    65    66  
   64    65    66  
   67    68    69    70  
   65    66  
   66  
    0  
   68    69    70  
   69    70  
   70  
    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  -0.175000   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   4.2000   0.3000   0.102500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.478700   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.2500   0.1700  -1.076200   1.8650   1.6500   0.051222218  -2.220205820
   47   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700   0.685000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.227000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.065000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   59   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   60   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   63   3.2500   0.1700  -0.418000   1.8100   1.6000   0.054801302  -1.445846770
   64   3.5500   0.0700   0.473000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.012000   1.3810   1.2100   0.030040813   0.268726247
   66   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   67   3.5000   0.0660   0.022200   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    40   469.000  1.400
   38    55   469.000  1.400
   40    41   367.000  1.080
   40    44   469.000  1.400
   44    45   367.000  1.080
   44    48   469.000  1.400
   48    49   367.000  1.080
   48    51   469.000  1.400
   51    52   367.000  1.080
   51    55   469.000  1.400
   55    58   225.000  1.779
   58    59   735.000  1.471
   58    60   735.000  1.471
   58    63   245.000  1.722
   63    39   380.000  1.395
   63    67   300.000  1.458
   39    42   465.000  1.376
   42    43   745.000  1.250
   42    46   415.000  1.382
   46    47   434.000  1.010
   46    50   481.000  1.340
   50    53   469.000  1.400
   50    66   483.000  1.339
   53    54   367.000  1.080
   53    56   469.000  1.400
   56    57   367.000  1.080
   56    61   469.000  1.400
   61    62   367.000  1.080
   61    64   469.000  1.400
   64    65   367.000  1.080
   64    66   483.000  1.339
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   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    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    85.00000  114.68000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    40    70.00000  120.00000
   33    38    55    70.00000  120.00000
   33    39    63    70.00000  115.00000
   33    39    42    70.00000  124.00000
   38    33    34    85.00000  111.85700
   38    40    41    35.00000  120.00000
   38    40    44    63.00000  120.00000
   38    55    51    63.00000  120.00000
   38    55    58    65.00000  117.06700
   40    44    45    35.00000  120.00000
   40    44    48    63.00000  120.00000
   44    40    41    35.00000  120.00000
   44    48    49    35.00000  120.00000
   44    48    51    63.00000  120.00000
   48    44    45    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    55    63.00000  120.00000
   51    48    49    35.00000  120.00000
   51    55    58    65.00000  117.06700
   55    38    40    63.00000  120.00000
   55    51    52    35.00000  120.00000
   55    58    59   100.00000  107.67100
   55    58    60   100.00000  107.67100
   55    58    63    95.00000  101.59200
   58    63    39    75.00000  117.67500
   58    63    67    75.00000  117.08200
   60    58    59   115.00000  120.17200
   63    58    59   115.00000  107.22500
   63    58    60   115.00000  107.22500
   63    39    42    65.00000  121.22700
   63    67    68    50.00000  109.35000
   63    67    69    50.00000  109.35000
   63    67    70    50.00000  109.35000
   39    33    34    85.00000  110.90400
   39    33    38    70.00000  112.99600
   39    42    43    65.00000  137.10300
   39    42    46    75.00000  114.40000
   42    46    47    50.00000  121.48000
   42    46    50    75.00000  121.78000
   46    42    43   105.00000  113.92000
   46    50    53    70.00000  120.10000
   46    50    66    80.00000  117.25000
   50    46    47    35.00000  113.50000
   50    53    54    35.00000  120.00000
   50    53    56    63.00000  120.00000
   50    66    64    70.00000  117.00000
   53    56    57    35.00000  120.00000
   53    56    61    63.00000  120.00000
   56    53    54    35.00000  120.00000
   56    61    62    35.00000  120.00000
   56    61    64    63.00000  120.00000
   61    56    57    35.00000  120.00000
   61    64    65    35.00000  120.00000
   61    64    66    70.00000  124.00000
   64    61    62    35.00000  120.00000
   66    50    53    70.00000  124.00000
   66    64    65    35.00000  116.00000
   67    63    39    70.00000  118.22000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    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    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    40  -0.16000  1.0 1.0
   29    33    38    40  -0.03200 -1.0 2.0
   29    33    38    40   0.04500  1.0 3.0
   29    33    38    55  -0.16000  1.0 1.0
   29    33    38    55  -0.03200 -1.0 2.0
   29    33    38    55   0.04500  1.0 3.0
   29    33    39    63   0.09700  1.0 1.0
   29    33    39    63   0.15600 -1.0 2.0
   29    33    39    63  -0.50800  1.0 3.0
   29    33    39    42   0.42700  1.0 1.0
   29    33    39    42  -0.70350 -1.0 2.0
   29    33    39    42  -0.43150  1.0 3.0
   33    38    40    41   3.62500 -1.0 2.0
   33    38    40    44   3.62500 -1.0 2.0
   33    38    55    51   3.62500 -1.0 2.0
   33    38    55    58   3.62500 -1.0 2.0
   33    39    42    43   7.00000 -1.0 2.0
   33    39    42    46   7.00000 -1.0 2.0
   34    33    38    40   0.64500  1.0 1.0
   34    33    38    40   0.14800 -1.0 2.0
   34    33    38    40   0.20650  1.0 3.0
   34    33    38    55   0.64500  1.0 1.0
   34    33    38    55   0.14800 -1.0 2.0
   34    33    38    55   0.20650  1.0 3.0
   34    33    39    63   0.09700  1.0 1.0
   34    33    39    63   0.15600 -1.0 2.0
   34    33    39    63  -0.50800  1.0 3.0
   34    33    39    42   0.39000  1.0 1.0
   34    33    39    42  -0.05800 -1.0 2.0
   34    33    39    42  -0.55150  1.0 3.0
   38    33    39    63   0.09700  1.0 1.0
   38    33    39    63   0.15600 -1.0 2.0
   38    33    39    63  -0.50800  1.0 3.0
   38    33    39    42   1.44450  1.0 1.0
   38    33    39    42   0.06600 -1.0 2.0
   38    33    39    42   0.29250  1.0 3.0
   38    40    44    45   3.62500 -1.0 2.0
   38    40    44    48   3.62500 -1.0 2.0
   38    55    58    59   0.19500  1.0 1.0
   38    55    58    59   0.12000 -1.0 2.0
   38    55    58    60   0.19500  1.0 1.0
   38    55    58    60   0.12000 -1.0 2.0
   38    55   -58    63  -0.49050  1.0 1.0
   38    55   -58    63   0.22250 -1.0 2.0
   38    55   -58    63  -0.39350  1.0 3.0
   40    38    55    51   3.62500 -1.0 2.0
   40    38    55    58   3.62500 -1.0 2.0
   40    44    48    49   3.62500 -1.0 2.0
   40    44   -48    51   3.62500 -1.0 2.0
   41    40    44    45   3.62500 -1.0 2.0
   41    40    44    48   3.62500 -1.0 2.0
   44    48    51    52   3.62500 -1.0 2.0
   44    48    51    55   3.62500 -1.0 2.0
   45    44    48    49   3.62500 -1.0 2.0
   45    44    48    51   3.62500 -1.0 2.0
   48    51   -55    38   3.62500 -1.0 2.0
   48    51    55    58   3.62500 -1.0 2.0
   49    48    51    52   3.62500 -1.0 2.0
   49    48    51    55   3.62500 -1.0 2.0
   51    55    58    59   0.19500  1.0 1.0
   51    55    58    59   0.12000 -1.0 2.0
   51    55    58    60   0.19500  1.0 1.0
   51    55    58    60   0.12000 -1.0 2.0
   51    55    58    63  -0.49050  1.0 1.0
   51    55    58    63   0.22250 -1.0 2.0
   51    55    58    63  -0.39350  1.0 3.0
   52    51    55    38   3.62500 -1.0 2.0
   52    51    55    58   3.62500 -1.0 2.0
   55    38    40    41   3.62500 -1.0 2.0
   55    38   -40    44   3.62500 -1.0 2.0
   55    58    63    39  -0.64500  1.0 1.0
   55    58    63    39  -1.19050 -1.0 2.0
   55    58    63    39  -0.04400  1.0 3.0
   55    58    63    67  -0.64500  1.0 1.0
   55    58    63    67  -1.19050 -1.0 2.0
   55    58    63    67  -0.04400  1.0 3.0
   58    63   -39    33   2.00000 -1.0 2.0
   58    63    39    42   2.00000 -1.0 2.0
   58    63    67    68   0.15000  1.0 3.0
   58    63    67    69   0.15000  1.0 3.0
   58    63    67    70   0.15000  1.0 3.0
   59    58    63    39   0.75000  1.0 3.0
   59    58    63    67  -0.30400  1.0 1.0
   59    58    63    67   0.50450 -1.0 2.0
   59    58    63    67   0.65550  1.0 3.0
   60    58    63    39   0.75000  1.0 3.0
   60    58    63    67  -0.30400  1.0 1.0
   60    58    63    67   0.50450 -1.0 2.0
   60    58    63    67   0.65550  1.0 3.0
   63    39    42    43   7.00000 -1.0 2.0
   63    39    42    46   7.00000 -1.0 2.0
   39    33    38    40   0.18050 -1.0 2.0
   39    33   -38    55   0.18050 -1.0 2.0
   39    63    67    68   0.23200  1.0 1.0
   39    63    67    68   0.02100 -1.0 2.0
   39    63    67    68   0.24950  1.0 3.0
   39    63    67    69   0.23200  1.0 1.0
   39    63    67    69   0.02100 -1.0 2.0
   39    63    67    69   0.24950  1.0 3.0
   39    63    67    70   0.23200  1.0 1.0
   39    63    67    70   0.02100 -1.0 2.0
   39    63    67    70   0.24950  1.0 3.0
   39    42    46    47   1.00000 -1.0 2.0
   39    42    46    50  -0.54500  1.0 1.0
   39    42    46    50   1.14150 -1.0 2.0
   42    46    50    53   0.70250  1.0 1.0
   42    46    50    53   1.56150 -1.0 2.0
   42    46    50    66   0.96250 -1.0 2.0
   43    42    46    47   1.00000 -1.0 2.0
   43    42    46    50   1.00000 -1.0 2.0
   46    50    53    54   3.62500 -1.0 2.0
   46    50    53    56   3.62500 -1.0 2.0
   46    50    66    64   3.62500 -1.0 2.0
   47    46    50    53   1.00000 -1.0 2.0
   47    46    50    66   1.75000 -1.0 2.0
   50    53    56    57   3.62500 -1.0 2.0
   50    53    56    61   3.62500 -1.0 2.0
   53    50    66    64   3.62500 -1.0 2.0
   53    56    61    62   3.62500 -1.0 2.0
   53    56   -61    64   3.62500 -1.0 2.0
   54    53    56    57   3.62500 -1.0 2.0
   54    53    56    61   3.62500 -1.0 2.0
   56    61    64    65   3.62500 -1.0 2.0
   56    61    64    66   3.62500 -1.0 2.0
   57    56    61    62   3.62500 -1.0 2.0
   57    56    61    64   3.62500 -1.0 2.0
   61    64   -66    50   3.62500 -1.0 2.0
   62    61    64    65   3.62500 -1.0 2.0
   62    61    64    66   3.62500 -1.0 2.0
   65    64    66    50   3.62500 -1.0 2.0
   66    50    53    54   3.62500 -1.0 2.0
   66    50   -53    56   3.62500 -1.0 2.0
   67    63    39    33   2.00000 -1.0 2.0
   67    63    39    42   2.00000 -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
   40    55    38    33   4.00000 -1.0 2.0
   44    41    40    38   1.10000 -1.0 2.0
   48    45    44    40   1.10000 -1.0 2.0
   51    49    48    44   1.10000 -1.0 2.0
   55    52    51    48   1.10000 -1.0 2.0
   51    58    55    38   4.00000 -1.0 2.0
   67    58    63    39   1.00000 -1.0 2.0
   33    63    39    42   1.10000 -1.0 2.0
   46    43    42    39   1.10000 -1.0 2.0
   47    42    46    50   1.00000 -1.0 2.0
   53    66    50    46   4.00000 -1.0 2.0
   56    54    53    50   1.10000 -1.0 2.0
   61    57    56    53   1.10000 -1.0 2.0
   64    62    61    56   1.10000 -1.0 2.0
   66    65    64    61   1.10000 -1.0 2.0
END
