* LIGAND DATABASE FILE (OPLS2005)
*
001      71    71    126    193     374
    1     0 S   NP   _N1_     1    29.90244    94.95603   -15.80701
    2     1 S   H    _HN1     2     1.03554   139.71556    79.57724
    3     1 S   H    _H1_     3     1.02871    42.51724   128.55448
    4     1 S   H    _H2_     4     1.02692    72.19873   -17.44569
    5     1 S   CT   _CA1     5     1.49868   104.81928  -127.07687
    6     5 S   HC   _HA1     6     1.09681   104.79098    14.27205
    7     5 S   CO3  _C1_     7     1.54339   111.20483  -103.06971
    8     7 S   O2Z  _O11     8     1.26205   116.19433   -97.62972
    9     7 S   O2Z  _O12     9     1.26470   114.04823    81.37273
   10     5 S   CT   _CB1    10     1.53147   107.75888   130.52019
   11    10 S   HC   HB11    11     1.09820   110.15520   -46.32714
   12    10 S   HC   HB12    12     1.09732   110.63282    70.32647
   13    10 S   CT   _CG1    13     1.53035   111.42882  -166.48223
   14    13 S   HC   HG11    14     1.09582   111.47863   -52.37605
   15    13 S   HC   HG12    15     1.09627   110.37026    66.14914
   16    13 S   C    _CD1    16     1.51307   111.02665  -173.72527
   17    16 S   O    _OE1    17     1.22816   121.85213   -96.99389
   18    16 S   N    _N2_    18     1.38274   112.64681    82.39854
   19    18 S   H    _HN2    19     1.01635   118.95924     3.48212
   20    18 S   CT1  _CA2    20     1.45850   123.15925   177.26119
   21    20 S   HC   _HA2    21     1.09727   108.97974    22.72904
   22    20 S   C    _C2_    22     1.52901   106.99119   -94.33939
   23    22 S   O    _O2_    23     1.22953   122.92094   -27.88194
   24    20 S   CT   _CB2    32     1.53058   111.82553   145.98615
   25    24 S   HC   HB21    33     1.09615   110.05520    52.20752
   26    24 S   HC   HB22    34     1.09515   110.86212   171.40061
   27    22 S   N    _N3_    24     1.38623   112.44170   154.71346
   28    27 S   H    _HN3    25     1.01516   119.69885     1.71418
   29    24 S   S    _SG2    35     1.82275   110.70877   -68.62927
   30    27 S   CT   _CA3    26     1.45459   122.85978   176.75780
   31    30 S   HC   HA31    27     1.09536   109.05856    29.22090
   32    30 S   HC   HA32    28     1.09489   107.20774   146.23731
   33    29 S   CT   _C17    36     1.82032    98.64327   164.35154
   34    33 S   HC   _H14    37     1.09421   109.24164   -57.65533
   35    33 S   HC   _H15    38     1.09384   108.18344    59.67629
   36    30 S   CO3  _C3_    29     1.52948   113.16267   -94.06265
   37    36 S   O2Z  _O31    30     1.26398   115.44320   -43.55336
   38    36 S   O2Z  _O32    31     1.26355   114.97916   137.34290
   39    33 S   CM   _C15    39     1.49417   110.52769  -178.27603
   40    39 S   CMA  _C16    40     1.51671   122.87530  -114.12850
   41    40 S   OM   _O40    41     1.26317   121.06997   133.73869
   42    40 S   OM   _O41    42     1.26317   120.54744   -46.67814
   43    39 S   OS   _O39    43     1.38306   118.01797    56.80777
   44    43 S   CT   _C6_    44     1.44050   112.18707    86.81390
   45    44 S   HC   _H3_    45     1.09944   111.03297   -12.33222
   46    44 S   CM   _C5_    46     1.50143   107.73102   106.52638
   47    46 S   HC   _H8_    47     1.08711   117.34727   -47.92249
   48    46 S   CM   _C4_    48     1.33835   123.76024   131.52379
   49    48 S   HC   _H7_    49     1.08753   118.47570  -177.92067
   50    48 S   CT   _C9_    50     1.50265   123.47172     2.36579
   51    50 S   HC   _H6_    51     1.09794   107.35739  -112.65148
   52    50 S   CT   _C8_    52     1.54234   113.88484    10.04776
   53    52 S   HC   _H5_    53     1.09923   111.41628    84.19889
   54    50 S   CO4  _C10    61     1.53345   106.08233   131.84433
   55    54 S   O    _O33    62     1.23188   121.80996   -66.37497
   56    44 S   CT   _C7_    54     1.54352   106.94135  -131.83638
   57    56 S   HC   _H4_    55     1.09726   109.43981   -34.83660
   58    52 S   CO3  _C14    58     1.54354   105.00664  -160.12501
   59    58 S   O2Z  _O37    59     1.26350   116.22873    92.13856
   60    58 S   O2Z  _O36    60     1.26386   114.79974   -87.49517
   61    54 S   CT   _C11    63     1.52210   115.96252   111.96241
   62    61 S   HC   _H9_    64     1.09571   107.98875    58.15306
   63    61 S   HC   _H10    65     1.09602   107.66558   -58.63039
   64    56 S   OH   _O38    56     1.43434   107.37997    80.67676
   65    64 S   HO   _H13    57     0.97407   108.06382  -177.74832
   66    61 S   CT   _C12    66     1.52257   112.80552   179.83214
   67    66 S   HC   _H11    67     1.09736   109.54387   -59.45685
   68    66 S   HC   _H12    68     1.09740   109.63399    57.54811
   69    66 S   CO3  _C13    69     1.53108   114.89510   178.90425
   70    69 S   O2Z  _O35    70     1.26522   114.10254   178.81717
   71    69 S   O2Z  _O34    71     1.26154   116.63990    -1.38409
  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   6   5   4   3
   8   4   3   2   1   1   8   4   2   1   9  13   7  10   4  10
   4  15   7  11   7  10   4   6   3   3   1   1   8   5   4   1
   1   5   4   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    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    43  
   39    40    43  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    56  
   41    42    43    44  
   42    43  
   43  
   44    45    46    47    48    52    56    57    64  
   45    46    47    48    49    50    52    53    56    57    64    65    58  
   46    47    48    52    56    57    64  
   47    48    49    50    51    52    56    57    64    54  
   48    49    50    56  
   49    50    51    52    53    56    58    54    55    61  
   50    51    52    54  
   51    52    53    56    57    64    58    59    60    54    55    61    62    63    66  
   52    53    56    58    54    55    61  
   53    56    57    64    65    58    59    60    54    55    61  
   56    57    64    58    59    60    54  
   55    61    62    63    66    67    68    69    56    58  
   61    62    63    66  
   57    64    65    58    59    60  
   64    65    58  
   59    60    64  
   60  
    0  
   62    63    66    67    68    69    70    71  
   63    66    67    68    69  
   66    67    68    69  
   65  
    0  
   67    68    69    70    71  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.047500   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   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   317.000  1.510
   39    40   465.000  1.376
   39    43   440.000  1.360
   40    41   745.000  1.250
   40    42   745.000  1.250
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   317.000  1.510
   44    56   268.000  1.529
   46    47   340.000  1.080
   46    48   549.000  1.340
   48    49   340.000  1.080
   48    50   317.000  1.510
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    54   317.000  1.522
   52    53   340.000  1.090
   52    56   268.000  1.529
   52    58   317.000  1.522
   56    57   340.000  1.090
   56    64   320.000  1.410
   64    65   553.000  0.945
   58    59   656.000  1.250
   58    60   656.000  1.250
   54    55   570.000  1.229
   54    61   317.000  1.522
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   317.000  1.522
   69    70   656.000  1.250
   69    71   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  112.20000
   33    39    40    70.00000  124.00000
   33    39    43    85.00000  112.85300
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    65.00000  137.10300
   39    43    44    90.00000  111.18400
   42    40    41    65.00000  121.00000
   43    39    40    80.00000  120.01400
   43    44    45    35.00000  109.50000
   43    44    46    85.00000  110.90400
   43    44    56    50.00000  109.50000
   44    46    47    35.00000  117.00000
   44    46    48    70.00000  124.00000
   44    56    52    58.35000  112.70000
   44    56    57    37.50000  110.70000
   44    56    64    50.00000  109.50000
   46    44    45    35.00000  109.50000
   46    48    49    35.00000  120.00000
   46    48    50    70.00000  124.00000
   48    46    47    35.00000  120.00000
   48    50    51    35.00000  109.50000
   48    50    52    70.00000  112.02700
   48    50    54    70.00000  109.06800
   50    48    49    35.00000  117.00000
   50    52    53    37.50000  110.70000
   50    52    56    58.35000  112.70000
   50    52    58    70.00000  109.69300
   50    54    55    80.00000  120.40000
   50    54    61    70.00000  116.00000
   52    50    51    37.50000  110.70000
   52    56    57    37.50000  110.70000
   52    56    64    50.00000  109.50000
   52    58    59    70.00000  117.00000
   52    58    60    70.00000  117.00000
   56    44    45    37.50000  110.70000
   56    44    46    70.00000  112.02700
   56    52    53    37.50000  110.70000
   56    64    65    55.00000  108.50000
   64    56    57    35.00000  109.50000
   58    52    53    35.00000  109.50000
   58    52    56    70.00000  109.69300
   60    58    59    80.00000  126.00000
   54    50    51    35.00000  109.50000
   54    50    52    63.00000  111.10000
   54    61    62    35.00000  109.50000
   54    61    63    35.00000  109.50000
   54    61    66    63.00000  111.10000
   61    54    55    80.00000  120.40000
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    69    70.00000  109.69300
   63    61    62    33.00000  107.80000
   66    61    62    37.50000  110.70000
   66    61    63    37.50000  110.70000
   66    69    70    70.00000  117.00000
   66    69    71    70.00000  117.00000
   68    66    67    33.00000  107.80000
   69    66    67    35.00000  109.50000
   69    66    68    35.00000  109.50000
   71    69    70    80.00000  126.00000
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  -0.62250  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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    43    44   2.00000 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    43   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    43   0.00000  1.0 1.0
   39    43    44    45   0.08050  1.0 3.0
   39    43    44    46  -0.48150  1.0 1.0
   39    43    44    46   0.09250 -1.0 2.0
   39    43    44    46  -0.12850  1.0 3.0
   39    43    44    56  -0.46850  1.0 1.0
   39    43    44    56   0.09300 -1.0 2.0
   39    43    44    56  -0.12850  1.0 3.0
   40    39    43    44  -2.26850  1.0 1.0
   40    39    43    44   3.39050 -1.0 2.0
   43    39    40    41   7.00000 -1.0 2.0
   43    39    40    42   7.00000 -1.0 2.0
   43    44    46    47   0.00000  1.0 1.0
   43    44    46    48   0.39000  1.0 1.0
   43    44    46    48  -0.05800 -1.0 2.0
   43    44    46    48  -0.55150  1.0 3.0
   43    44    56    52   0.62750  1.0 1.0
   43    44    56    52  -0.30950 -1.0 2.0
   43    44    56    52   0.27300  1.0 3.0
   43    44    56    57   0.23400  1.0 3.0
   43    44    56    64   3.69350  1.0 1.0
   43    44    56    64  -1.82950 -1.0 2.0
   44    46    48    49   7.00000 -1.0 2.0
   44    46    48    50   7.00000 -1.0 2.0
   44    56    64    65  -0.11600  1.0 1.0
   44    56    64    65  -0.09450 -1.0 2.0
   44    56    64    65   0.21250  1.0 3.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    48   0.00000  1.0 1.0
   45    44    56    52   0.15000  1.0 3.0
   45    44    56    57   0.15000  1.0 3.0
   45    44    56    64   0.23400  1.0 3.0
   46    44    56    52   0.34400  1.0 1.0
   46    44    56    52   0.09450 -1.0 2.0
   46    44    56    52   0.11100  1.0 3.0
   46    44    56    57   0.15000  1.0 3.0
   46    44    56    64   1.05650  1.0 1.0
   46    44    56    64   0.15600 -1.0 2.0
   46    44    56    64   0.53150  1.0 3.0
   46    48    50    51   0.00000  1.0 1.0
   46    48   -50    52   0.09850  1.0 1.0
   46    48   -50    52   0.15250 -1.0 2.0
   46    48   -50    52  -0.50650  1.0 3.0
   46    48    50    54  -0.51250  1.0 1.0
   46    48    50    54  -0.88800 -1.0 2.0
   46    48    50    54   0.08850  1.0 3.0
   47    46    48    49   7.00000 -1.0 2.0
   47    46    48    50   7.00000 -1.0 2.0
   48    50    52    53   0.15000  1.0 3.0
   48    50    52    56   0.34400  1.0 1.0
   48    50    52    56   0.09450 -1.0 2.0
   48    50    52    56   0.11100  1.0 3.0
   48    50    52    58  -0.98800  1.0 1.0
   48    50    52    58   0.48800 -1.0 2.0
   48    50    52    58   0.76800  1.0 3.0
   48    50    54    55   0.30150 -1.0 2.0
   48    50    54    61   0.65300  1.0 1.0
   48    50    54    61  -0.03850 -1.0 2.0
   48    50    54    61   0.33900  1.0 3.0
   49    48    50    51   0.33100  1.0 3.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    54   0.00000  1.0 1.0
   50    52   -56    44   0.56750  1.0 1.0
   50    52   -56    44  -0.07550 -1.0 2.0
   50    52   -56    44   0.20000  1.0 3.0
   50    52    56    57   0.15000  1.0 3.0
   50    52    56    64   0.86500  1.0 1.0
   50    52    56    64  -0.17500 -1.0 2.0
   50    52    56    64   0.20800  1.0 3.0
   50    52    58    59   0.41150 -1.0 2.0
   50    52    58    60   0.41150 -1.0 2.0
   50    54    61    62   0.00000  1.0 1.0
   50    54    61    63   0.00000  1.0 1.0
   50    54    61    66   0.60050  1.0 1.0
   50    54    61    66   0.05600 -1.0 2.0
   50    54    61    66   0.26150  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    56   0.15000  1.0 3.0
   51    50    52    58  -0.11250  1.0 3.0
   51    50    54    55   0.00000  1.0 1.0
   51    50    54    61   0.00000  1.0 1.0
   52    50    54    55   0.30150 -1.0 2.0
   52    50    54    61   0.60050  1.0 1.0
   52    50    54    61   0.05600 -1.0 2.0
   52    50    54    61   0.26150  1.0 3.0
   52    56    64    65  -0.11600  1.0 1.0
   52    56    64    65  -0.09450 -1.0 2.0
   52    56    64    65   0.21250  1.0 3.0
   53    52    56    44   0.15000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    64   0.23400  1.0 3.0
   53    52    58    59   0.00000  1.0 1.0
   53    52    58    60   0.00000  1.0 1.0
   56    44    46    47   0.00000  1.0 1.0
   56    44   -46    48   0.09850  1.0 1.0
   56    44   -46    48   0.15250 -1.0 2.0
   56    44   -46    48  -0.50650  1.0 3.0
   56    52    58    59   0.41150 -1.0 2.0
   56    52    58    60   0.41150 -1.0 2.0
   57    56    64    65   0.19450  1.0 3.0
   58    52    56    44  -1.63150  1.0 1.0
   58    52    56    44  -0.43550 -1.0 2.0
   58    52    56    44   0.24500  1.0 3.0
   58    52    56    57  -0.11250  1.0 3.0
   58    52    56    64  -5.33000  1.0 1.0
   58    52    56    64  -0.54250 -1.0 2.0
   58    52    56    64  -0.07300  1.0 3.0
   54    50    52    53  -0.11250  1.0 3.0
   54    50    52    56  -0.95700  1.0 1.0
   54    50    52    56  -0.18200 -1.0 2.0
   54    50    52    56   0.29450  1.0 3.0
   54    50    52    58  -0.30950  1.0 1.0
   54    50    52    58   1.11150 -1.0 2.0
   54    50    52    58   0.40350  1.0 3.0
   54    61    66    67  -0.11250  1.0 3.0
   54    61    66    68  -0.11250  1.0 3.0
   54    61    66    69  -0.30950  1.0 1.0
   54    61    66    69   1.11150 -1.0 2.0
   54    61    66    69   0.40350  1.0 3.0
   55    54    61    62   0.00000  1.0 1.0
   55    54    61    63   0.00000  1.0 1.0
   55    54    61    66   0.30150 -1.0 2.0
   61    66    69    70   0.41150 -1.0 2.0
   61    66    69    71   0.41150 -1.0 2.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    68   0.15000  1.0 3.0
   62    61    66    69  -0.11250  1.0 3.0
   63    61    66    67   0.15000  1.0 3.0
   63    61    66    68   0.15000  1.0 3.0
   63    61    66    69  -0.11250  1.0 3.0
   67    66    69    70   0.00000  1.0 1.0
   67    66    69    71   0.00000  1.0 1.0
   68    66    69    70   0.00000  1.0 1.0
   68    66    69    71   0.00000  1.0 1.0
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
   33    43    39    40  15.00000 -1.0 2.0
   41    42    40    39  15.00000 -1.0 2.0
   44    47    46    48   1.10000 -1.0 2.0
   50    49    48    46   1.10000 -1.0 2.0
   59    52    58    60  10.50000 -1.0 2.0
   50    61    54    55  10.50000 -1.0 2.0
   70    66    69    71  10.50000 -1.0 2.0
END
