* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    127    199     370
    1     0 S   NP   _N1_     1    28.72300    95.05533   -24.02368
    2     1 S   H    _HN1     2     1.02964    78.66649    25.91673
    3     1 S   H    _H1_     3     1.02834    30.30579  -174.88986
    4     1 S   H    _H2_     4     1.02778   107.92589   -79.88059
    5     1 S   CT   _CA1     5     1.50135   132.55621   133.24798
    6     5 S   HC   _HA1     6     1.09578   105.20958    84.15560
    7     5 S   CO3  _C1_     7     1.53773   112.42610   -35.97908
    8     7 S   O2Z  _O11     8     1.26355   115.00240   -42.79342
    9     7 S   O2Z  _O12     9     1.26244   114.91829   136.34906
   10     5 S   CT   _CB1    10     1.53093   107.41284  -157.98952
   11    10 S   HC   HB11    11     1.09826   109.23507   -51.17998
   12    10 S   HC   HB12    12     1.09820   110.43425    65.32926
   13    10 S   CT   _CG1    13     1.53021   112.73919  -172.32964
   14    13 S   HC   HG11    14     1.09596   110.41257   -65.02712
   15    13 S   HC   HG12    15     1.09655   110.00020    54.20189
   16    13 S   C    _CD1    16     1.51821   112.32375   174.45765
   17    16 S   O    _OE1    17     1.22726   123.25294    -2.54768
   18    16 S   N    _N2_    18     1.38641   111.67702   177.80929
   19    18 S   H    _HN2    19     1.01589   119.05028     0.49732
   20    18 S   CT1  _CA2    20     1.46108   123.32868   179.35776
   21    20 S   HC   _HA2    21     1.09593   109.27551    -9.03683
   22    20 S   C    _C2_    22     1.53496   108.64181  -124.21292
   23    22 S   O    _O2_    23     1.23032   122.12639  -147.68542
   24    20 S   CT   _CB2    32     1.53352   111.68906   113.41472
   25    24 S   HC   HB21    33     1.09654   109.65033    59.46614
   26    24 S   HC   HB22    34     1.09565   111.02307   176.89953
   27    22 S   N    _N3_    24     1.38480   113.49910    39.85645
   28    27 S   H    _HN3    25     1.01513   118.92352    -0.81349
   29    24 S   S    _SG2    35     1.82806   114.48455   -60.45372
   30    27 S   CT   _CA3    26     1.45453   123.51006   174.87245
   31    30 S   HC   HA31    27     1.09518   109.31200    23.14004
   32    30 S   HC   HA32    28     1.09497   107.11148   140.17234
   33    29 S   CT   _C13    36     1.82683    99.70768   -68.56302
   34    33 S   HC   _H15    37     1.09491   108.06414   -51.26572
   35    33 S   HC   _H16    38     1.09322   108.83807    67.40573
   36    30 S   CO3  _C3_    29     1.52923   113.03246  -100.37325
   37    36 S   O2Z  _O31    30     1.26407   115.37937   -44.80707
   38    36 S   O2Z  _O32    31     1.26349   114.99745   136.08868
   39    33 S   CT   _C6_    39     1.52757   110.47748  -171.77930
   40    39 S   HC   _H4_    40     1.09842   110.24414   -50.77623
   41    39 S   CT   _C5_    41     1.52370   112.33974  -173.78804
   42    41 S   HC   _H3_    42     1.09677   111.34057   -39.85513
   43    41 S   CT   _C4_    43     1.51042   101.54987  -157.36300
   44    43 S   HC   _H7_    44     1.09471   113.01413   158.98288
   45    43 S   HC   _H8_    45     1.09589   110.44187   -81.99642
   46    41 S   OH   _O35    67     1.41235   111.71967    82.73551
   47    46 S   HO   _H17    68     0.97250   107.60981   173.46067
   48    43 S   CO   _C7_    46     1.52137   101.63077    38.23227
   49    48 S   HC   _H5_    47     1.09593   109.56092    87.76052
   50    48 S   N*   _N4_    48     1.45627   114.49690  -149.17821
   51    39 S   OS   _O33    66     1.43957   110.60359    69.07476
   52    50 S   CDX  _C8_    49     1.36730   125.36256  -129.48784
   53    52 S   CT   _C11    50     1.50677   109.95961   177.80162
   54    53 S   HC   _H6_    51     1.09260   111.83522  -103.37924
   55    53 S   CG   _C10    52     1.46812   106.46982   131.59614
   56    53 S   N    _N8_    62     1.43227    99.69631    13.65933
   57    56 S   H    _H14    63     1.01472   125.31186   178.18911
   58    55 S   NG   _N6_    53     1.33174   115.53449    40.84697
   59    58 S   H    _H11    54     1.01477   118.41772   178.80270
   60    55 S   NG   _N7_    59     1.32329   120.14985  -140.86927
   61    60 S   H    _H12    60     1.01322   121.11171     1.20675
   62    60 S   H    _H13    61     1.01363   120.72754  -179.43421
   63    50 S   C    _C12    64     1.38291   124.96874    60.53406
   64    63 S   O    _O34    65     1.22331   128.12353    -3.72073
   65    58 S   CT   _C9_    55     1.47683   120.34022    -2.07773
   66    65 S   HC   _H9_    56     1.09416   107.34123  -159.40365
   67    65 S   HC   _H10    57     1.09537   109.17782    83.42729
   68    52 S   NI   _N5_    58     1.28929   125.60804    -4.40442
  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  10   7  10   6   5   3   1   9
   4  11   2  13  13   7  12   6   2   8   5   3   1   1   2   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    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    51  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    48    51    46  
   35    39    40    41    51  
   39    40    41    51  
   37    38  
   38  
    0  
   40    41    42    43    44    45    48    49    50    51    46    47  
   41    42    43    48    51    46  
   42    43    44    45    48    49    50    51    46    47  
   43    44    45    48    51    46    47  
   44    45    48    49    50    52    63    51    46    47  
   45    48    49    50    51    46  
   48    49    50    51    46  
   47    48    51  
    0  
   49    50    52    53    68    56    63    64    51  
   50    52    63    51  
   52    53    54    55    65    68    56    57    63    64    51  
   52    63  
   53    54    55    58    65    66    67    68    60    56    57    63    64  
   54    55    58    59    65    68    60    61    62    56    57    63    64  
   55    58    68    60    56    57    63  
   58    59    65    66    67    68    60    61    62    56    57    63  
   57    63    64    58    60    68  
   63    64  
   59    65    66    67    68    60    61    62  
   65    66    67    68    60  
   61    62    65  
   62  
    0  
   64    68  
    0  
   66    67    68  
   67    68  
   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   0.205000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.655000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.0000   0.0000   0.390000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.100000   1.3810   1.2100   0.008598240   0.268726247
   50   3.2500   0.1700  -0.367500   1.8100   1.6000   0.054801302  -1.445846770
   51   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.7500   0.1050   0.481500   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.321800   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   2.2500   0.0500   0.280700   2.0020   1.7750   0.023028004  -0.852763146
   56   3.2500   0.1700  -0.518100   1.8100   1.6000   0.054801302  -1.445846770
   57   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   58   3.2500   0.1700  -0.340900   1.8650   1.6500   0.051222218  -2.220205820
   59   0.0000   0.0000   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.747100   2.2900   2.0360   0.003973653   1.685851020
   61   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   62   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.7500   0.1050   0.813700   1.9250   1.7000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   65   3.5000   0.0660   0.349400   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.2800   0.1700  -0.516000   1.8540   1.6400   0.005000000   0.000000000
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    51   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   250.000  1.527
   48    49   340.000  1.090
   48    50   275.000  1.479
   48    51   320.000  1.380
   50    52   360.000  1.429
   50    63   418.000  1.388
   52    53   260.000  1.508
   52    68   650.000  1.285
   53    54   340.000  1.090
   53    55   290.000  1.488
   53    56   337.000  1.449
   55    58   481.000  1.340
   55    60   481.000  1.340
   58    59   434.000  1.010
   58    65   337.000  1.463
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   315.000  1.435
   60    61   434.000  1.010
   60    62   434.000  1.010
   56    57   434.000  1.010
   56    63   490.000  1.335
   63    64   570.000  1.229
   46    47   553.000  0.945
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    51    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    46    50.00000  109.50000
   39    51    48    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    48    75.00000  109.43000
   41    46    47    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    48    49    45.00000  112.01100
   43    48    50    75.00000  107.44000
   43    48    51    90.00000  108.56700
   45    43    44    33.00000  107.80000
   48    43    44    45.00000  108.72000
   48    43    45    45.00000  108.72000
   48    50    52    70.00000  121.20000
   48    50    63    70.00000  117.60000
   50    48    49    55.00000  103.44000
   50    52    53    70.00000  106.88000
   50    52    68    80.00000  119.04400
   50    63    56    90.00000  111.91700
   50    63    64    80.00000  120.60000
   52    53    54    45.00000  109.58200
   52    53    55    60.00000  115.84000
   52    53    56    75.00000  110.78400
   52    68    65    75.00000  112.28000
   53    55    58    70.00000  119.45300
   53    55    60    70.00000  119.45300
   53    56    57    38.00000  118.40000
   53    56    63    50.00000  121.90000
   55    53    54    45.00000  109.33400
   55    58    59    35.00000  120.00000
   55    58    65    50.00000  123.20000
   55    60    61    35.00000  120.00000
   55    60    62    35.00000  120.00000
   58    65    66    35.00000  109.50000
   58    65    67    35.00000  109.50000
   58    65    68    85.00000  110.25000
   65    58    59    35.00000  118.40000
   67    65    66    33.00000  107.80000
   68    52    53    70.00000  118.34500
   68    65    66    50.00000  110.29200
   68    65    67    50.00000  110.29200
   60    55    58    70.00000  120.00000
   62    60    61    35.00000  120.00000
   56    53    54    35.00000  109.50000
   56    53    55    75.00000  110.78400
   56    63    64    80.00000  122.90000
   63    50    52    70.00000  121.60000
   63    56    57    35.00000  119.80000
   51    39    40    35.00000  109.50000
   51    39    41    50.00000  109.50000
   51    48    49    35.00000  109.50000
   51    48    50   105.00000  106.22000
   46    41    42    35.00000  109.50000
   46    41    43    50.00000  109.50000
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    51   0.56750  1.0 1.0
   29    33    39    51  -0.07550 -1.0 2.0
   29    33    39    51   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    46   0.86500  1.0 1.0
   33    39    41    46  -0.17500 -1.0 2.0
   33    39    41    46   0.20800  1.0 3.0
   33    39    51    48   0.06250  1.0 1.0
   33    39    51    48  -0.01100 -1.0 2.0
   33    39    51    48   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    51   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    51   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    45   0.15000  1.0 3.0
   39    41   -43    48   3.97050  1.0 1.0
   39    41    46    47  -0.11600  1.0 1.0
   39    41    46    47  -0.09450 -1.0 2.0
   39    41    46    47   0.21250  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    46   0.23400  1.0 3.0
   40    39    51    48   0.37050  1.0 3.0
   41    39   -51    48   0.06250  1.0 1.0
   41    39   -51    48  -0.01100 -1.0 2.0
   41    39   -51    48   0.28050  1.0 3.0
   41    43    48    49   0.15000  1.0 3.0
   41    43    48    50  -0.27100  1.0 1.0
   41    43    48    50  -0.01700 -1.0 2.0
   41    43    48    50  -0.48600  1.0 3.0
   41    43   -48    51   0.62750  1.0 1.0
   41    43   -48    51  -0.30950 -1.0 2.0
   41    43   -48    51   0.27300  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.15000  1.0 3.0
   42    41    46    47   0.19450  1.0 3.0
   43    41    46    47  -0.11600  1.0 1.0
   43    41    46    47  -0.09450 -1.0 2.0
   43    41    46    47   0.21250  1.0 3.0
   43    48    50    52   2.08450  1.0 1.0
   43    48    50    52  -0.39300 -1.0 2.0
   43    48    50    52   0.23400  1.0 3.0
   43    48    50    63  -0.43950  1.0 1.0
   43    48    50    63  -0.08100 -1.0 2.0
   43    48    50    63   0.03350  1.0 3.0
   43    48   -51    39   0.06250  1.0 1.0
   43    48   -51    39  -0.01100 -1.0 2.0
   43    48   -51    39   0.28050  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    51   0.23400  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    50   0.15000  1.0 3.0
   45    43    48    51   0.23400  1.0 3.0
   48    50    52    53   3.62500 -1.0 2.0
   48    50    52    68   3.62500 -1.0 2.0
   48    50    63    56   3.62500 -1.0 2.0
   48    50    63    64   3.04450 -1.0 2.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    63   0.00000  1.0 1.0
   49    48    51    39   0.37050  1.0 3.0
   50    48    51    39  -2.37750  1.0 1.0
   50    48    51    39  -0.08150 -1.0 2.0
   50    48    51    39   0.59000  1.0 3.0
   50    52    53    54   0.00000  1.0 1.0
   50    52    53    55  -1.35150  1.0 1.0
   50    52    53    55   0.13900 -1.0 2.0
   50    52    53    55   0.25250  1.0 3.0
   50    52   -53    56   0.00000  1.0 1.0
   50    52    68    65   6.00000 -1.0 2.0
   52    50   -63    56   3.62500 -1.0 2.0
   52    50    63    64   2.67200 -1.0 2.0
   52    53    55    58  -1.35150  1.0 1.0
   52    53    55    58   0.13900 -1.0 2.0
   52    53    55    58   0.25250  1.0 3.0
   52    53    55    60  -1.35150  1.0 1.0
   52    53    55    60   0.13900 -1.0 2.0
   52    53    55    60   0.25250  1.0 3.0
   52    53    56    57   0.00000  1.0 1.0
   52    53   -56    63  -0.19250  1.0 1.0
   52    53   -56    63  -0.00500 -1.0 2.0
   52    53   -56    63   0.17000  1.0 3.0
   53    52    68    65   6.00000 -1.0 2.0
   53    55    58    59   1.50000 -1.0 2.0
   53    55   -58    65   6.00000 -1.0 2.0
   53    55    60    61   1.50000 -1.0 2.0
   53    55    60    62   1.50000 -1.0 2.0
   53    56   -63    50   4.56800  1.0 1.0
   53    56   -63    50   0.31650 -1.0 2.0
   53    56    63    64   3.04450 -1.0 2.0
   54    53    55    58   0.00000  1.0 1.0
   54    53    55    60   0.00000  1.0 1.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    63   0.00000  1.0 1.0
   55    53    56    57   0.00000  1.0 1.0
   55    53    56    63  -0.19250  1.0 1.0
   55    53    56    63  -0.00500 -1.0 2.0
   55    53    56    63   0.17000  1.0 3.0
   55    58    65    66   0.08850  1.0 3.0
   55    58    65    67   0.08850  1.0 3.0
   55    58    65    68  -0.12500  1.0 1.0
   55    58    65    68  -0.12500 -1.0 2.0
   55    58    65    68   0.25000  1.0 3.0
   58    55    60    61   1.50000 -1.0 2.0
   58    55    60    62   1.50000 -1.0 2.0
   58    65   -68    52  -0.12500  1.0 1.0
   58    65   -68    52  -0.12500 -1.0 2.0
   58    65   -68    52   0.25000  1.0 3.0
   59    58    65    66   0.00000  1.0 1.0
   59    58    65    67   0.00000  1.0 1.0
   59    58    65    68   0.00000  1.0 1.0
   66    65    68    52  -0.15000  1.0 3.0
   67    65    68    52  -0.15000  1.0 3.0
   68    52    53    54   0.00000  1.0 1.0
   68    52   -53    55   0.00000  1.0 1.0
   68    52    53    56   0.00000  1.0 1.0
   60    55    58    59   1.50000 -1.0 2.0
   60    55    58    65   3.96800 -1.0 2.0
   56    53    55    58   0.00000  1.0 1.0
   56    53    55    60   0.00000  1.0 1.0
   57    56    63    50   2.56700 -1.0 2.0
   57    56    63    64   2.45000 -1.0 2.0
   63    50   -52    53  -0.45200  1.0 1.0
   63    50   -52    53   0.85900 -1.0 2.0
   63    50   -52    53   0.16650  1.0 3.0
   63    50    52    68  -0.56400  1.0 1.0
   63    50    52    68   0.77500 -1.0 2.0
   63    50    52    68   0.18700  1.0 3.0
   51    39    41    42   0.23400  1.0 3.0
   51    39   -41    43   0.62750  1.0 1.0
   51    39   -41    43  -0.30950 -1.0 2.0
   51    39   -41    43   0.27300  1.0 3.0
   51    39    41    46   3.69350  1.0 1.0
   51    39    41    46  -1.82950 -1.0 2.0
   51    48    50    52  -0.28000  1.0 1.0
   51    48    50    52  -1.16550 -1.0 2.0
   51    48    50    63  -2.75650  1.0 1.0
   51    48    50    63  -1.18150 -1.0 2.0
   51    48    50    63   0.81900  1.0 3.0
   46    41    43    44   0.23400  1.0 3.0
   46    41    43    45   0.23400  1.0 3.0
   46    41    43    48   0.86500  1.0 1.0
   46    41    43    48  -0.17500 -1.0 2.0
   46    41    43    48   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   63    52    50    48   1.00000 -1.0 2.0
   50    53    52    68  10.50000 -1.0 2.0
   58    53    55    60  10.50000 -1.0 2.0
   59    55    58    65   1.00000 -1.0 2.0
   61    62    60    55   1.00000 -1.0 2.0
   57    63    56    53   1.00000 -1.0 2.0
   50    56    63    64  10.50000 -1.0 2.0
END
