* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    123    192     358
    1     0 S   NP   _N1_     1    29.45795    91.27109   -19.96726
    2     1 S   H    _HN1     2     1.02957   115.09501    85.76872
    3     1 S   H    _H1_     3     1.02790     9.91723    46.76532
    4     1 S   H    _H2_     4     1.03038   109.55459   -35.30636
    5     1 S   CT   _CA1     5     1.50138   102.01419  -154.67484
    6     5 S   HC   _HA1     6     1.09567   105.33143    51.67506
    7     5 S   CO3  _C1_     7     1.53714   112.37104   -68.81121
    8     7 S   O2Z  _O11     8     1.26373   115.01269   -47.34252
    9     7 S   O2Z  _O12     9     1.26232   114.94931   131.91675
   10     5 S   CT   _CB1    10     1.52954   107.31381   169.42618
   11    10 S   HC   HB11    11     1.09748   109.02790   -53.20886
   12    10 S   HC   HB12    12     1.09809   110.46578    63.22676
   13    10 S   CT   _CG1    13     1.52805   113.31229  -173.69849
   14    13 S   HC   HG11    14     1.09548   111.27573   -66.41692
   15    13 S   HC   HG12    15     1.09596   110.83426    53.00444
   16    13 S   C    _CD1    16     1.51425   109.63487   172.24106
   17    16 S   O    _OE1    17     1.22881   121.67876   -92.96200
   18    16 S   N    _N2_    18     1.38373   113.15258    85.17156
   19    18 S   H    _HN2    19     1.01571   119.29544     6.12986
   20    18 S   CT1  _CA2    20     1.45678   122.43220  -179.88986
   21    20 S   HC   _HA2    21     1.09614   108.58438    29.18224
   22    20 S   C    _C2_    22     1.52961   107.37722   -87.75539
   23    22 S   O    _O2_    23     1.22931   122.89610   -29.25918
   24    20 S   CT   _CB2    32     1.53193   112.60946   152.69438
   25    24 S   HC   HB21    33     1.09662   109.90367    59.29865
   26    24 S   HC   HB22    34     1.09586   110.83293   176.54475
   27    22 S   N    _N3_    24     1.38628   112.32194   153.74720
   28    27 S   H    _HN3    25     1.01491   119.75503     0.72036
   29    24 S   S    _SG2    35     1.82689   114.56989   -60.82185
   30    27 S   CT   _CA3    26     1.45459   122.90662   174.94906
   31    30 S   HC   HA31    27     1.09531   109.05523    28.53217
   32    30 S   HC   HA32    28     1.09479   107.16016   145.72714
   33    29 S   CT   _C13    36     1.82708    99.95265   -61.74452
   34    33 S   HC   _H9_    37     1.09473   108.90933   -38.65383
   35    33 S   HC   _H10    38     1.09374   107.42674    79.28411
   36    30 S   CO3  _C3_    29     1.53060   113.46559   -94.52220
   37    36 S   O2Z  _O31    30     1.26388   115.76084   -31.41802
   38    36 S   O2Z  _O32    31     1.26399   114.71583   149.42920
   39    33 S   CT   _C12    39     1.53417   110.99103  -159.22046
   40    39 S   HC   _H6_    40     1.09671   110.36077    54.75644
   41    39 S   CT   _C11    41     1.53313   111.86973   178.82613
   42    41 S   HC   _H5_    42     1.09732   112.78617   -32.06829
   43    41 S   CT   _C10    43     1.52257   101.73557    88.97252
   44    43 S   HC   _H4_    44     1.09640   109.76198   -79.59015
   45    41 S   OS   _O35    65     1.43207   107.38345  -156.16245
   46    43 S   CO   _C9_    45     1.52081   101.65705    38.11153
   47    46 S   HC   _H3_    46     1.09637   112.31534    84.57402
   48    43 S   OH   _O38    63     1.41484   114.31515   159.09923
   49    48 S   HO   _H11    64     0.98090   107.99325    -3.80791
   50    45 S   PR   _P1_    66     1.62041   117.65461   134.99943
   51    50 S   OM   _O37    67     1.64154    97.81895    75.37183
   52    50 S   OM   _O36    68     1.63994    97.57360   174.41651
   53    46 S   N*   _N7_    47     1.45097   113.71722  -152.67482
   54    39 S   OS   _O34    62     1.44663   109.84252   -63.80050
   55    53 S   CRAB _C4_    48     1.37393   126.49863    81.75738
   56    55 S   HA   _H7_    49     1.08102   122.27503    -0.23239
   57    55 S   NNA  _N4_    50     1.31846   112.47477   179.68910
   58    57 S   CB   _C5_    51     1.36349   103.86286     0.15066
   59    53 S   CN   _C8_    52     1.36695   126.75437   -98.34588
   60    59 S   NNC  _N6_    53     1.35309   126.96662     0.28462
   61    60 S   CDX  _C7_    54     1.31311   113.45068   179.89913
   62    61 S   NNB  _N5_    55     1.40818   122.81516     0.17017
   63    62 S   H    _H8_    56     1.01385   117.92556   179.89721
   64    61 S   NND  _N8_    59     1.36687   121.60819  -179.85735
   65    64 S   H    _H12    60     1.01412   120.26015     0.36850
   66    64 S   H    _H13    61     1.01266   122.18311   179.82529
   67    58 S   C    _C6_    57     1.43764   128.56731  -180.00000
   68    67 S   O    _O33    58     1.22504   123.86658     0.39017
  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   7   5   4   3
  10   5   4   2   1   1  12   6  13   7  11   7   6  11   5   3
   1   2   1   1   9   2   6   3   6   7   6   7   7   6   3   3
   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    54  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    46    54    45  
   35    39    40    41    54  
   39    40    41    54  
   37    38  
   38  
    0  
   40    41    42    43    44    46    47    53    54    48    45    50  
   41    42    43    46    54    45  
   42    43    44    46    47    53    54    48    49    45    50    51    52  
   43    44    46    54    48    45    50  
   44    46    47    53    55    59    54    48    49    45    50  
   46    47    53    54    48    49    45  
   50    51    52    46    48    54  
   47    53    55    56    57    58    59    60    54    48    49  
   53    55    59    54    48  
   49    53    54  
    0  
   51    52  
   52  
    0  
   55    56    57    58    59    60    61    67    54  
   55    59  
   56    57    58    59    60    67  
   57    58    59  
   58    59    60    62    67    68  
   59    60    61    62    63    67    68  
   60    61    62    67    68    64  
   61    62    63    67    64    65    66  
   62    63    67    68    64    65    66  
   63    67    68    64    65    66  
   67    68    64  
   65    66    67  
   66  
    0  
   68  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.9000   0.1400  -1.312500   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7400   0.2000   0.937500   2.1070   1.8700   0.005000000   0.000000000
   51   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   52   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   53   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   54   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   57   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   58   3.5000   0.0800   0.120000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0800   0.340000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.2500   0.1700  -0.510000   1.9250   1.7000   0.054801302  -2.445846770
   61   3.5000   0.0800   0.460000   2.1120   1.8750   0.001000000  -0.126889456
   62   3.2500   0.1700  -0.560000   2.1120   1.8750   0.051222218  -2.220205820
   63   0.0000   0.0000   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   64   3.2500   0.1700  -0.800000   2.1120   1.8750   0.051222218  -2.220205820
   65   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   66   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.7500   0.1050   0.520000   1.9250   1.7000   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.510000   1.5250   1.4250   0.001000000  -1.480495490
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    54   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    45   320.000  1.410
   43    44   340.000  1.090
   43    46   250.000  1.527
   43    48   320.000  1.410
   46    47   340.000  1.090
   46    53   275.000  1.479
   46    54   320.000  1.380
   53    55   440.000  1.371
   53    59   436.000  1.374
   55    56   367.000  1.080
   55    57   529.000  1.304
   57    58   414.000  1.391
   58    59   520.000  1.370
   58    67   447.000  1.419
   59    60   461.000  1.354
   60    61   585.000  1.311
   61    62   427.000  1.381
   61    64   481.000  1.340
   62    63   434.000  1.010
   62    67   418.000  1.388
   67    68   570.000  1.229
   64    65   434.000  1.010
   64    66   434.000  1.010
   48    49   553.000  0.945
   45    50   325.000  1.672
   50    51   325.000  1.672
   50    52   325.000  1.672
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    54    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    45    50.00000  109.50000
   39    54    46    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    46    75.00000  109.43000
   41    43    48    50.00000  109.50000
   41    45    50   100.00000  120.50000
   43    41    42    37.50000  110.70000
   43    46    47    45.00000  112.01100
   43    46    53    75.00000  107.44000
   43    46    54    90.00000  108.56700
   43    48    49    55.00000  108.50000
   46    43    44    45.00000  108.72000
   46    53    55    70.00000  128.80000
   46    53    59    70.00000  125.80000
   53    46    47    55.00000  103.44000
   53    55    56    35.00000  123.05000
   53    55    57    70.00000  113.90000
   53    59    58    70.00000  106.20000
   53    59    60    70.00000  126.20000
   55    57    58    70.00000  103.80000
   57    55    56    35.00000  123.05000
   57    58    59    70.00000  110.40000
   57    58    67    70.00000  130.00000
   58    59    60    70.00000  127.70000
   58    67    62    70.00000  111.30000
   58    67    68    80.00000  128.80000
   59    53    55    70.00000  105.40000
   59    60    61    70.00000  112.20000
   60    61    62    70.00000  123.30000
   60    61    64    70.00000  119.30000
   61    62    63    35.00000  118.00000
   61    62    67    70.00000  125.20000
   61    64    65    35.00000  120.00000
   61    64    66    35.00000  120.00000
   62    67    68    80.00000  120.60000
   67    58    59    85.00000  119.20000
   67    62    63    35.00000  116.80000
   64    61    62    70.00000  116.00000
   66    64    65    35.00000  120.00000
   54    39    40    35.00000  109.50000
   54    39    41    50.00000  109.50000
   54    46    47    35.00000  109.50000
   54    46    53   105.00000  106.22000
   48    43    44    35.00000  109.50000
   48    43    46    90.00000  111.58700
   45    41    42    35.00000  109.50000
   45    41    43    50.00000  109.50000
   45    50    51    45.00000  102.60000
   45    50    52    45.00000  102.60000
   52    50    51    35.00000   94.00000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    54   0.56750  1.0 1.0
   29    33    39    54  -0.07550 -1.0 2.0
   29    33    39    54   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    45   0.62750  1.0 1.0
   33    39    41    45  -0.30950 -1.0 2.0
   33    39    41    45   0.27300  1.0 3.0
   33    39    54    46   0.06250  1.0 1.0
   33    39    54    46  -0.01100 -1.0 2.0
   33    39    54    46   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    54   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    54   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41   -43    46   3.97050  1.0 1.0
   39    41    43    48   0.86500  1.0 1.0
   39    41    43    48  -0.17500 -1.0 2.0
   39    41    43    48   0.20800  1.0 3.0
   39    41    45    50  -2.65550  1.0 1.0
   39    41    45    50  -0.22350 -1.0 2.0
   39    41    45    50   0.24150  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    54    46   0.37050  1.0 3.0
   41    39   -54    46   0.06250  1.0 1.0
   41    39   -54    46  -0.01100 -1.0 2.0
   41    39   -54    46   0.28050  1.0 3.0
   41    43    46    47   0.15000  1.0 3.0
   41    43    46    53  -0.64600  1.0 1.0
   41    43    46    53   0.58400 -1.0 2.0
   41    43   -46    54   0.62750  1.0 1.0
   41    43   -46    54  -0.30950 -1.0 2.0
   41    43   -46    54   0.27300  1.0 3.0
   41    43    48    49  -0.11600  1.0 1.0
   41    43    48    49  -0.09450 -1.0 2.0
   41    43    48    49   0.21250  1.0 3.0
   41    45    50    51   0.05050  1.0 1.0
   41    45    50    51  -1.30700 -1.0 2.0
   41    45    50    51   0.91550  1.0 3.0
   41    45    50    52   0.05050  1.0 1.0
   41    45    50    52  -1.30700 -1.0 2.0
   41    45    50    52   0.91550  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    46   0.15000  1.0 3.0
   42    41    43    48   0.23400  1.0 3.0
   42    41    45    50   0.03000  1.0 3.0
   43    41    45    50  -2.65550  1.0 1.0
   43    41    45    50  -0.22350 -1.0 2.0
   43    41    45    50   0.24150  1.0 3.0
   43    46    53    55   1.10250  1.0 1.0
   43    46    53    55   0.01650 -1.0 2.0
   43    46    53    55   0.39100  1.0 3.0
   43    46    53    59   1.10250  1.0 1.0
   43    46    53    59   0.01650 -1.0 2.0
   43    46    53    59   0.39100  1.0 3.0
   43    46   -54    39   0.06250  1.0 1.0
   43    46   -54    39  -0.01100 -1.0 2.0
   43    46   -54    39   0.28050  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    53   0.15000  1.0 3.0
   44    43    46    54   0.23400  1.0 3.0
   44    43    48    49   0.19450  1.0 3.0
   46    43    48    49  -0.11600  1.0 1.0
   46    43    48    49  -0.09450 -1.0 2.0
   46    43    48    49   0.21250  1.0 3.0
   46    53    55    56   3.62500 -1.0 2.0
   46    53    55    57   3.62500 -1.0 2.0
   46    53    59    58   0.81400  1.0 1.0
   46    53    59    58   1.55550 -1.0 2.0
   46    53    59    60   3.62500 -1.0 2.0
   47    46    53    55   0.00000  1.0 1.0
   47    46    53    59   0.00000  1.0 1.0
   47    46    54    39   0.37050  1.0 3.0
   53    46    54    39  -2.37750  1.0 1.0
   53    46    54    39  -0.08150 -1.0 2.0
   53    46    54    39   0.59000  1.0 3.0
   53    55   -57    58   3.62500 -1.0 2.0
   53    59    60    61   1.25000 -1.0 2.0
   55    53   -59    58   0.70250  1.0 1.0
   55    53   -59    58   1.56150 -1.0 2.0
   55    53    59    60   3.62500 -1.0 2.0
   55    57   -58    59   3.62500 -1.0 2.0
   55    57    58    67   3.62500 -1.0 2.0
   56    55    57    58   3.62500 -1.0 2.0
   57    58   -59    53   3.62500 -1.0 2.0
   57    58    59    60   3.62500 -1.0 2.0
   57    58    67    62   5.37500 -1.0 2.0
   57    58    67    68   0.41000 -1.0 2.0
   58    59    60    61   3.62500 -1.0 2.0
   59    53    55    56   3.62500 -1.0 2.0
   59    53   -55    57   3.62500 -1.0 2.0
   59    58    67    62   1.50000 -1.0 2.0
   59    58    67    68   1.05000 -1.0 2.0
   59    60   -61    62   3.62500 -1.0 2.0
   59    60    61    64   3.62500 -1.0 2.0
   60    61    62    63   3.62500 -1.0 2.0
   60    61    62    67   3.62500 -1.0 2.0
   60    61    64    65   0.70000 -1.0 2.0
   60    61    64    66   0.70000 -1.0 2.0
   61    62   -67    58   1.52500 -1.0 2.0
   61    62    67    68   3.04450 -1.0 2.0
   62    61    64    65   1.01500 -1.0 2.0
   62    61    64    66   1.01500 -1.0 2.0
   63    62    67    58   1.52500 -1.0 2.0
   63    62    67    68   2.45000 -1.0 2.0
   67    58    59    53   3.62500 -1.0 2.0
   67    58   -59    60   3.62500 -1.0 2.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    67   3.62500 -1.0 2.0
   54    39    41    42   0.23400  1.0 3.0
   54    39   -41    43   0.62750  1.0 1.0
   54    39   -41    43  -0.30950 -1.0 2.0
   54    39   -41    43   0.27300  1.0 3.0
   54    39    41    45   1.11900  1.0 1.0
   54    39    41    45  -1.16350 -1.0 2.0
   54    39    41    45  -0.34150  1.0 3.0
   54    46    53    55   0.10350  1.0 1.0
   54    46    53    55  -0.15350 -1.0 2.0
   54    46    53    59   0.10350  1.0 1.0
   54    46    53    59  -0.15350 -1.0 2.0
   48    43    46    47   0.23400  1.0 3.0
   48    43    46    53   2.76900  1.0 1.0
   48    43    46    53  -0.24350 -1.0 2.0
   48    43    46    53  -0.78250  1.0 3.0
   48    43    46    54   3.69350  1.0 1.0
   48    43    46    54  -1.82950 -1.0 2.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    46   0.62750  1.0 1.0
   45    41    43    46  -0.30950 -1.0 2.0
   45    41    43    46   0.27300  1.0 3.0
   45    41    43    48   3.69350  1.0 1.0
   45    41    43    48  -1.82950 -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
   37    30    36    38  10.50000 -1.0 2.0
   55    59    53    46   4.00000 -1.0 2.0
   57    56    55    53   1.10000 -1.0 2.0
   59    67    58    57   4.00000 -1.0 2.0
   58    60    59    53   4.00000 -1.0 2.0
   62    64    61    60  10.50000 -1.0 2.0
   63    61    62    67   1.00000 -1.0 2.0
   58    62    67    68  10.50000 -1.0 2.0
   66    61    64    65   1.00000 -1.0 2.0
END
