* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    138    225     415
    1     0 S   NP   _N1_     1    28.74708    96.52619   -24.01229
    2     1 S   H    _HN1     2     1.02948    70.96817     9.25204
    3     1 S   H    _H1_     3     1.02828    37.64285   172.23669
    4     1 S   H    _H2_     4     1.02790   109.90611   -94.01993
    5     1 S   CT   _CA1     5     1.50114   134.42189   109.54267
    6     5 S   HC   _HA1     6     1.09574   105.18167    94.73767
    7     5 S   CO3  _C1_     7     1.53772   112.45880   -25.48578
    8     7 S   O2Z  _O11     8     1.26372   115.01124   -42.95923
    9     7 S   O2Z  _O12     9     1.26237   114.93715   136.12220
   10     5 S   CT   _CB1    10     1.53069   107.41350  -147.30119
   11    10 S   HC   HB11    11     1.09837   109.33493   -49.70744
   12    10 S   HC   HB12    12     1.09811   110.47019    66.88609
   13    10 S   CT   _CG1    13     1.53009   112.62959  -170.66790
   14    13 S   HC   HG11    14     1.09576   110.68127   -66.58789
   15    13 S   HC   HG12    15     1.09671   109.74224    52.65611
   16    13 S   C    _CD1    16     1.51808   112.10676   173.10841
   17    16 S   O    _OE1    17     1.22745   123.23176     9.54289
   18    16 S   N    _N2_    18     1.38651   111.76091  -170.47280
   19    18 S   H    _HN2    19     1.01580   118.96811     1.31284
   20    18 S   CT1  _CA2    20     1.46209   123.37268   176.92337
   21    20 S   HC   _HA2    21     1.09738   109.30283     5.71025
   22    20 S   C    _C2_    22     1.53625   108.82629  -109.78836
   23    22 S   O    _O2_    23     1.23075   122.23518  -148.93045
   24    20 S   CT   _CB2    32     1.53314   111.59572   127.69033
   25    24 S   HC   HB21    33     1.09523   110.03680    56.73685
   26    24 S   HC   HB22    34     1.09524   110.12371   175.73998
   27    22 S   N    _N3_    24     1.38311   113.82758    38.57687
   28    27 S   H    _HN3    25     1.01560   119.61034    -3.28211
   29    24 S   S    _SG2    35     1.82827   111.49869   -64.66899
   30    27 S   CT   _CA3    26     1.45289   123.26809   177.15023
   31    30 S   HC   HA31    27     1.09548   107.50910   -64.77439
   32    30 S   HC   HA32    28     1.09555   107.99760    51.68155
   33    29 S   CT   _C15    36     1.84643    99.67976   179.31016
   34    33 S   HC   _H6_    37     1.09782   106.06688    30.80651
   35    30 S   CO3  _C3_    29     1.52973   114.04377   173.67631
   36    35 S   O2Z  _O31    30     1.26382   116.06471    -0.68041
   37    35 S   O2Z  _O32    31     1.26423   114.42094   179.38324
   38    33 S   CM   _C14    38     1.50707   109.20305   -82.60573
   39    38 S   HC   _H16    39     1.09040   116.41000    41.93587
   40    38 S   CMA  _C13    40     1.35057   126.43917  -141.24522
   41    40 S   OM   _O33    41     1.26258   127.92058  -176.99736
   42    40 S   CM   _C11    42     1.49313   118.54950     0.43656
   43    42 S   CT   _C10    43     1.54464   114.54325   -20.12480
   44    43 S   HC   _H5_    44     1.10218   106.04636   -64.59112
   45    42 S   CM   _C12    70     1.35166   123.32830   158.54838
   46    45 S   HC   _H14    71     1.08275   122.97722  -179.40917
   47    45 S   HC   _H15    72     1.08587   122.33810    -0.17017
   48    43 S   CT   _C9_    45     1.54411   115.17251   179.32391
   49    48 S   HC   _H12    46     1.09610   109.62719   -58.31669
   50    48 S   HC   _H13    47     1.09813   109.15379    57.79066
   51    48 S   CT   _C8_    48     1.53711   113.82220   178.00954
   52    51 S   HC   _H4_    49     1.09700   109.05955   -72.25010
   53    51 S   CT   _C7_    50     1.51867   112.61134    49.64999
   54    53 S   HC   _H3_    51     1.09895   110.57039  -165.51415
   55    53 S   CT   _C6_    52     1.52255   115.34314   -43.63145
   56    55 S   HC   _H10    53     1.09714   108.79571   169.21073
   57    55 S   HC   _H11    54     1.09851   106.52451   -76.29698
   58    53 S   OS   _O35    60     1.43191   104.34284    80.56457
   59    33 S   CT   _C5_    55     1.57281   113.86963   149.22286
   60    58 S   CO4  _C17    61     1.37359   108.45096    30.05014
   61    60 S   O    _O34    62     1.22118   124.39120   172.46503
   62    59 S   CT   _C4_    56     1.55389   111.97987    46.39006
   63    62 S   HC   _H7_    57     1.09509   112.02522    48.11633
   64    62 S   HC   _H8_    58     1.09545   111.65159   -72.25552
   65    62 S   HC   _H9_    59     1.09289   112.45066   168.57675
   66    51 S   CT   _C16    63     1.53388   113.31839   162.32845
   67    66 S   CT   _C18    64     1.52079   116.27734    37.75111
   68    67 S   HC   _H17    65     1.09541   110.64678    56.99582
   69    67 S   HC   _H18    66     1.09413   112.66853   -65.16972
   70    67 S   HC   _H19    67     1.09644   110.75201   174.90184
   71    66 S   OH   _O36    68     1.42488   109.22675   161.75029
   72    71 S   HO   _H20    69     0.97314   108.06499   176.43405
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  18   7   2   1   1   9   4   9   3  12  19   8   4   1   1  14
   6   5  17   8  12   7  10   4   3   6   4   8   3   3   2   1
   1   6   5   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    59    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    55    59    62  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    48    53    55    56    57    59    62    63    64    65  
   38    39    40    43    55    59    62  
   36    37  
   37  
    0  
   39    40    41    42    43    55    59    62    45  
   40    41    42    59  
   41    42    43    44    48    59    45    46    47  
   42    43    45  
   43    44    48    49    50    51    55    59    62    45    46    47  
   44    48    49    50    51    52    53    55    56    57    59    62    63    64    65    66    45    46    47  
   48    49    50    51    55    59    62    45  
   46    47    48    59  
   47  
    0  
   49    50    51    52    53    54    55    59    62    58    60    66    67    71  
   50    51    52    53    59    66  
   51    52    53    59    66  
   52    53    54    55    56    57    59    58    60    61    66    67    68    69    70    71    72  
   53    54    55    58    60    66    67    71  
   54    55    56    57    59    62    58    60    61    66    67    71  
   55    56    57    59    58    60    66  
   56    57    59    62    63    64    65    58    60    66  
   57    59    62    58  
   59    62    58  
   60    61    66    67    71    59  
   62    63    64    65  
   61    66    67    68    69    70    71    72  
   66    67    71  
   63    64    65  
   64    65  
   65  
    0  
   67    68    69    70    71    72  
   68    69    70    71    72  
   69    70    71  
   70    71  
   71  
   72  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    59   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   317.000  1.510
   42    45   549.000  1.340
   43    44   340.000  1.090
   43    48   268.000  1.529
   43    59   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    66   268.000  1.529
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    58   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    59   268.000  1.529
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   58    60   214.000  1.327
   60    61   570.000  1.229
   60    66   317.000  1.522
   66    67   268.000  1.529
   66    71   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   553.000  0.945
   45    46   340.000  1.080
   45    47   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    59    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    59    43    58.35000  112.70000
   33    59    55    58.35000  112.70000
   33    59    62    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    70.00000  124.00000
   40    42    45    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    43    44    35.00000  109.50000
   42    43    48    70.00000  112.02700
   42    43    59    70.00000  112.02700
   42    45    46    35.00000  120.00000
   42    45    47    35.00000  120.00000
   43    48    49    37.50000  110.70000
   43    48    50    37.50000  110.70000
   43    48    51    58.35000  112.70000
   43    59    55    58.35000  112.70000
   43    59    62    58.35000  112.70000
   48    43    44    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    66    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    55    58.35000  112.70000
   51    53    58    50.00000  109.50000
   51    66    60    63.00000  111.10000
   51    66    67    58.35000  112.70000
   51    66    71    50.00000  109.50000
   53    51    52    37.50000  110.70000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    59    58.35000  112.70000
   53    58    60    83.00000  116.90000
   55    53    54    37.50000  110.70000
   55    59    62    58.35000  112.70000
   57    55    56    33.00000  107.80000
   59    33    34    37.50000  110.70000
   59    33    38    70.00000  112.02700
   59    43    44    37.50000  110.70000
   59    43    48    58.35000  112.70000
   59    55    56    37.50000  110.70000
   59    55    57    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    64    37.50000  110.70000
   59    62    65    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   58    53    54    35.00000  109.50000
   58    53    55    50.00000  109.50000
   58    60    61    83.00000  123.40000
   58    60    66    81.00000  111.40000
   60    66    67    63.00000  111.10000
   60    66    71    90.00000  109.61100
   66    51    52    37.50000  110.70000
   66    51    53    58.35000  112.70000
   66    60    61    80.00000  120.40000
   66    67    68    37.50000  110.70000
   66    67    69    37.50000  110.70000
   66    67    70    37.50000  110.70000
   66    71    72    55.00000  108.50000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    66    67    50.00000  109.50000
   45    42    43    70.00000  124.00000
   47    45    46    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    59   0.01700  1.0 1.0
   24    29    33    59  -0.23550 -1.0 2.0
   24    29    33    59   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    59    43   0.44750  1.0 1.0
   29    33    59    43  -0.17800 -1.0 2.0
   29    33    59    43   0.20200  1.0 3.0
   29    33    59    55   0.44750  1.0 1.0
   29    33    59    55  -0.17800 -1.0 2.0
   29    33    59    55   0.20200  1.0 3.0
   29    33    59    62   0.44750  1.0 1.0
   29    33    59    62  -0.17800 -1.0 2.0
   29    33    59    62   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    59    62    63   0.15000  1.0 3.0
   33    59    62    64   0.15000  1.0 3.0
   33    59    62    65   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    59    43   0.15000  1.0 3.0
   34    33    59    55   0.15000  1.0 3.0
   34    33    59    62   0.15000  1.0 3.0
   38    33    59    43   0.34400  1.0 1.0
   38    33    59    43   0.09450 -1.0 2.0
   38    33    59    43   0.11100  1.0 3.0
   38    33    59    55   0.34400  1.0 1.0
   38    33    59    55   0.09450 -1.0 2.0
   38    33    59    55   0.11100  1.0 3.0
   38    33    59    62   0.34400  1.0 1.0
   38    33    59    62   0.09450 -1.0 2.0
   38    33    59    62   0.11100  1.0 3.0
   38    40   -42    43   7.00000 -1.0 2.0
   38    40    42    45   7.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    43    44   0.00000  1.0 1.0
   40    42    43    48   0.09850  1.0 1.0
   40    42    43    48   0.15250 -1.0 2.0
   40    42    43    48  -0.50650  1.0 3.0
   40    42    43    59   0.09850  1.0 1.0
   40    42    43    59   0.15250 -1.0 2.0
   40    42    43    59  -0.50650  1.0 3.0
   40    42    45    46   7.00000 -1.0 2.0
   40    42    45    47   7.00000 -1.0 2.0
   41    40    42    43   7.00000 -1.0 2.0
   41    40    42    45   7.00000 -1.0 2.0
   42    43    48    49   0.15000  1.0 3.0
   42    43    48    50   0.15000  1.0 3.0
   42    43    48    51   0.34400  1.0 1.0
   42    43    48    51   0.09450 -1.0 2.0
   42    43    48    51   0.11100  1.0 3.0
   42    43   -59    33   0.34400  1.0 1.0
   42    43   -59    33   0.09450 -1.0 2.0
   42    43   -59    33   0.11100  1.0 3.0
   42    43    59    55   0.34400  1.0 1.0
   42    43    59    55   0.09450 -1.0 2.0
   42    43    59    55   0.11100  1.0 3.0
   42    43    59    62   0.34400  1.0 1.0
   42    43    59    62   0.09450 -1.0 2.0
   42    43    59    62   0.11100  1.0 3.0
   43    42    45    46   7.00000 -1.0 2.0
   43    42    45    47   7.00000 -1.0 2.0
   43    48    51    52   0.15000  1.0 3.0
   43    48    51    53   0.56750  1.0 1.0
   43    48    51    53  -0.07550 -1.0 2.0
   43    48    51    53   0.20000  1.0 3.0
   43    48    51    66   0.56750  1.0 1.0
   43    48    51    66  -0.07550 -1.0 2.0
   43    48    51    66   0.20000  1.0 3.0
   43    59    62    63   0.15000  1.0 3.0
   43    59    62    64   0.15000  1.0 3.0
   43    59    62    65   0.15000  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   0.15000  1.0 3.0
   44    43    59    33   0.15000  1.0 3.0
   44    43    59    55   0.15000  1.0 3.0
   44    43    59    62   0.15000  1.0 3.0
   48    43    59    33   0.56750  1.0 1.0
   48    43    59    33  -0.07550 -1.0 2.0
   48    43    59    33   0.20000  1.0 3.0
   48    43    59    55   0.56750  1.0 1.0
   48    43    59    55  -0.07550 -1.0 2.0
   48    43    59    55   0.20000  1.0 3.0
   48    43    59    62   0.56750  1.0 1.0
   48    43    59    62  -0.07550 -1.0 2.0
   48    43    59    62   0.20000  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51   -53    55   0.56750  1.0 1.0
   48    51   -53    55  -0.07550 -1.0 2.0
   48    51   -53    55   0.20000  1.0 3.0
   48    51    53    58   0.62750  1.0 1.0
   48    51    53    58  -0.30950 -1.0 2.0
   48    51    53    58   0.27300  1.0 3.0
   48    51    66    60  -0.95700  1.0 1.0
   48    51    66    60  -0.18200 -1.0 2.0
   48    51    66    60   0.29450  1.0 3.0
   48    51    66    67   0.56750  1.0 1.0
   48    51    66    67  -0.07550 -1.0 2.0
   48    51    66    67   0.20000  1.0 3.0
   48    51    66    71   0.86500  1.0 1.0
   48    51    66    71  -0.17500 -1.0 2.0
   48    51    66    71   0.20800  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    66   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   50    48    51    66   0.15000  1.0 3.0
   51    53    55    56   0.15000  1.0 3.0
   51    53    55    57   0.15000  1.0 3.0
   51    53    55    59   0.56750  1.0 1.0
   51    53    55    59  -0.07550 -1.0 2.0
   51    53    55    59   0.20000  1.0 3.0
   51    53   -58    60  -0.25900  1.0 1.0
   51    53   -58    60  -0.47000 -1.0 2.0
   51    53   -58    60   0.11750  1.0 3.0
   51    66    67    68   0.15000  1.0 3.0
   51    66    67    69   0.15000  1.0 3.0
   51    66    67    70   0.15000  1.0 3.0
   51    66    71    72  -0.11600  1.0 1.0
   51    66    71    72  -0.09450 -1.0 2.0
   51    66    71    72   0.21250  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    58   0.23400  1.0 3.0
   52    51    66    60  -0.11250  1.0 3.0
   52    51    66    67   0.15000  1.0 3.0
   52    51    66    71   0.23400  1.0 3.0
   53    51   -66    60  -0.95700  1.0 1.0
   53    51   -66    60  -0.18200 -1.0 2.0
   53    51   -66    60   0.29450  1.0 3.0
   53    51    66    67   0.56750  1.0 1.0
   53    51    66    67  -0.07550 -1.0 2.0
   53    51    66    67   0.20000  1.0 3.0
   53    51    66    71   0.86500  1.0 1.0
   53    51    66    71  -0.17500 -1.0 2.0
   53    51    66    71   0.20800  1.0 3.0
   53    55    59    33   0.56750  1.0 1.0
   53    55    59    33  -0.07550 -1.0 2.0
   53    55    59    33   0.20000  1.0 3.0
   53    55   -59    43   0.56750  1.0 1.0
   53    55   -59    43  -0.07550 -1.0 2.0
   53    55   -59    43   0.20000  1.0 3.0
   53    55    59    62   0.56750  1.0 1.0
   53    55    59    62  -0.07550 -1.0 2.0
   53    55    59    62   0.20000  1.0 3.0
   53    58    60    61   3.00000 -1.0 2.0
   53    58   -60    66   1.63150  1.0 1.0
   53    58   -60    66   2.92000 -1.0 2.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    59   0.15000  1.0 3.0
   54    53    58    60   0.08050  1.0 3.0
   55    53    58    60  -0.25900  1.0 1.0
   55    53    58    60  -0.47000 -1.0 2.0
   55    53    58    60   0.11750  1.0 3.0
   55    59    62    63   0.15000  1.0 3.0
   55    59    62    64   0.15000  1.0 3.0
   55    59    62    65   0.15000  1.0 3.0
   56    55    59    33   0.15000  1.0 3.0
   56    55    59    43   0.15000  1.0 3.0
   56    55    59    62   0.15000  1.0 3.0
   57    55    59    33   0.15000  1.0 3.0
   57    55    59    43   0.15000  1.0 3.0
   57    55    59    62   0.15000  1.0 3.0
   59    33    38    39   0.00000  1.0 1.0
   59    33   -38    40   0.09850  1.0 1.0
   59    33   -38    40   0.15250 -1.0 2.0
   59    33   -38    40  -0.50650  1.0 3.0
   59    43    48    49   0.15000  1.0 3.0
   59    43    48    50   0.15000  1.0 3.0
   59    43   -48    51   0.56750  1.0 1.0
   59    43   -48    51  -0.07550 -1.0 2.0
   59    43   -48    51   0.20000  1.0 3.0
   58    53    55    56   0.23400  1.0 3.0
   58    53    55    57   0.23400  1.0 3.0
   58    53    55    59   0.62750  1.0 1.0
   58    53    55    59  -0.30950 -1.0 2.0
   58    53    55    59   0.27300  1.0 3.0
   58    60   -66    51   0.36750  1.0 3.0
   58    60    66    67   0.36750  1.0 3.0
   58    60    66    71   0.30750  1.0 1.0
   58    60    66    71   1.13850 -1.0 2.0
   58    60    66    71   0.38850  1.0 3.0
   60    66    67    68  -0.11250  1.0 3.0
   60    66    67    69  -0.11250  1.0 3.0
   60    66    67    70  -0.11250  1.0 3.0
   60    66    71    72   0.91850  1.0 1.0
   60    66    71    72   0.57950  1.0 3.0
   61    60    66    51   0.30150 -1.0 2.0
   61    60    66    67   0.30150 -1.0 2.0
   61    60    66    71   0.30150 -1.0 2.0
   66    51    53    54   0.15000  1.0 3.0
   66    51    53    55   0.56750  1.0 1.0
   66    51    53    55  -0.07550 -1.0 2.0
   66    51    53    55   0.20000  1.0 3.0
   66    51   -53    58   0.62750  1.0 1.0
   66    51   -53    58  -0.30950 -1.0 2.0
   66    51   -53    58   0.27300  1.0 3.0
   67    66    71    72  -0.11600  1.0 1.0
   67    66    71    72  -0.09450 -1.0 2.0
   67    66    71    72   0.21250  1.0 3.0
   71    66    67    68   0.23400  1.0 3.0
   71    66    67    69   0.23400  1.0 3.0
   71    66    67    70   0.23400  1.0 3.0
   45    42    43    44   0.00000  1.0 1.0
   45    42    43    48   0.09850  1.0 1.0
   45    42    43    48   0.15250 -1.0 2.0
   45    42    43    48  -0.50650  1.0 3.0
   45    42    43    59   0.09850  1.0 1.0
   45    42    43    59   0.15250 -1.0 2.0
   45    42    43    59  -0.50650  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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    45   1.10000 -1.0 2.0
   58    66    60    61  10.50000 -1.0 2.0
   46    47    45    42   1.10000 -1.0 2.0
END
