* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    136    206     392
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02104   102.62466   -41.54593
    3     1 S   H    _H1_     3     1.02020    73.01805    64.37926
    4     1 S   H    _H2_     4     1.02174    40.84490  -145.63535
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08584   110.00631   179.14591
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C15    36     1.86323    96.84317  -178.14607
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CA   _C7_    37     1.51639   108.24925   -39.98845
   38    33 S   CT   _C14    50     1.54451   114.97435  -158.51907
   39    38 S   HC   _H4_    51     1.10677   110.42715   172.05557
   40    37 S   CA   _C6_    38     1.40430   122.17151    86.44701
   41    40 S   HA   _H8_    39     1.08406   120.63622     0.05595
   42    38 S   OS   _O34    52     1.42966   107.06554   -73.70319
   43    40 S   CA   _C5_    40     1.39550   121.23004  -178.84937
   44    42 S   CM   _C17    53     1.40428    99.62369   -37.30263
   45    43 S   CA   _C10    41     1.38853   120.16968     0.68899
   46    33 S   CM   _C16    54     1.51055   107.11762    96.58497
   47    44 S   OH   _O35    59     1.36659   120.57743  -159.84308
   48    47 S   HO   _H15    60     0.96763   110.55158     1.62654
   49    43 S   CT   _C4_    70     1.49329   119.16936  -179.44362
   50    49 S   HC   _H5_    71     1.09618   110.30013    90.02068
   51    49 S   HC   _H6_    72     1.09703   111.19170  -149.48703
   52    49 S   HC   _H7_    73     1.09691   111.15678   -30.46905
   53    45 S   CA   _C9_    42     1.39259   119.73250     1.11188
   54    53 S   HA   _H9_    43     1.08780   118.84583   179.90721
   55    46 S   CT   _C18    55     1.48653   126.21695   -80.77455
   56    55 S   HC   _H16    56     1.09185   110.16576   -95.87020
   57    55 S   HC   _H17    57     1.09238   110.14624   144.00252
   58    55 S   HC   _H18    58     1.09220   110.14386    24.35716
   59    45 S   OS   _O33    65     1.36241   120.93516  -179.42939
   60    37 S   CA   _C8_    44     1.42416   119.16029   -89.06821
   61    59 S   CT   _C11    66     1.42610   117.00799    90.04467
   62    61 S   HC   _H10    67     1.09255   109.45928  -179.97202
   63    61 S   HC   _H11    68     1.09269   109.52835    59.21048
   64    61 S   HC   _H12    69     1.09288   108.98220   -60.43662
   65    60 S   CT   _C12    45     1.53488   122.84150    -2.29652
   66    65 S   HC   _H3_    46     1.09971   105.61830  -121.32760
   67    65 S   CT   _C13    47     1.54569   115.54302    -4.25266
   68    67 S   HC   _H13    48     1.09644   112.04944    99.57753
   69    67 S   HC   _H14    49     1.09754   109.85355  -145.11094
   70    65 S   CT   _C19    61     1.53432   112.12335   121.51626
   71    70 S   HC   _H19    62     1.08684   109.45762   -64.19215
   72    70 S   HC   _H20    63     1.08664   109.47647   175.82510
   73    70 S   HC   _H21    64     1.08670   109.50568    55.80611
  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  11   5   4   3
  20   2   1   1  18  14   7  12   4   9  10   8  13   8   2   1
   5   2   1   1   8   3   3   2   1   1   5   9   3   2   1   1
   8   7   6   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    60    67    38    39    42    44    46    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    43    53    60    65    67    68    69    38    39    42    44    46    55    56    57    58    47  
   35    36  
   36  
    0  
   40    41    43    45    53    54    60    65    66    67    38    39    42    44    46    55    70    49  
   39    42    44    46    55    47    70    40    60    65    66    67    68    69  
   42    44    46    65    67    68    69  
   41    43    45    53    60    65    46    59    49    50    51    52  
   43    45    60    49  
   44    46    55    47    48    65    67    68    69  
   45    53    54    60    59    61    49    50    51    52  
   46    55    56    57    58    47    48    67  
   53    54    60    65    59    61    62    63    64    49    50    51    52  
   55    56    57    58    47    48    60    67  
   48    55  
    0  
   50    51    52    53    59  
   51    52  
   52  
    0  
   54    60    65    66    67    70    59    61  
   60    65    59  
   56    57    58  
   57    58  
   58  
    0  
   61    62    63    64    60  
   65    66    67    68    69    70    71    72    73  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    72    73  
   67    68    69    70    71    72    73  
   68    69    70    71    72    73  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    38   268.000  1.529
   33    46   317.000  1.510
   37    40   469.000  1.400
   37    60   469.000  1.400
   40    41   367.000  1.080
   40    43   469.000  1.400
   43    45   469.000  1.400
   43    49   317.000  1.510
   45    53   469.000  1.400
   45    59   450.000  1.364
   53    54   367.000  1.080
   53    60   469.000  1.400
   60    65   317.000  1.510
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    70   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    38   268.000  1.529
   38    39   340.000  1.090
   38    42   320.000  1.410
   42    44   440.000  1.360
   44    46   549.000  1.340
   44    47   510.000  1.338
   46    55   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   47    48   553.000  0.945
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   59    61   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    46    75.00000  112.20000
   33    37    40    70.00000  120.00000
   33    37    60    70.00000  120.00000
   33    38    67    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    42    50.00000  109.50000
   33    46    44    70.00000  124.00000
   33    46    55    65.00000  117.92700
   37    40    41    35.00000  120.00000
   37    40    43    63.00000  120.00000
   37    60    53    63.00000  120.00000
   37    60    65    70.00000  120.00000
   40    43    45    63.00000  120.00000
   40    43    49    70.00000  120.00000
   43    40    41    35.00000  120.00000
   43    45    53    63.00000  120.00000
   43    45    59    70.00000  120.00000
   43    49    50    35.00000  109.50000
   43    49    51    35.00000  109.50000
   43    49    52    35.00000  109.50000
   45    53    54    35.00000  120.00000
   45    53    60    63.00000  120.00000
   45    59    61    75.00000  111.00000
   53    60    65    70.00000  120.00000
   60    37    40    63.00000  120.00000
   60    53    54    35.00000  120.00000
   60    65    66    35.00000  109.50000
   60    65    67    70.00000  112.17500
   60    65    70    70.00000  112.17500
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    38    58.35000  112.70000
   65    70    71    37.50000  110.70000
   65    70    72    37.50000  110.70000
   65    70    73    37.50000  110.70000
   67    65    66    37.50000  110.70000
   67    38    39    37.50000  110.70000
   67    38    42    50.00000  109.50000
   69    67    68    33.00000  107.80000
   38    33    37    70.00000  112.17500
   38    67    68    37.50000  110.70000
   38    67    69    37.50000  110.70000
   38    42    44    90.00000  111.18400
   42    38    39    35.00000  109.50000
   42    44    46    80.00000  120.01400
   42    44    47   115.00000  116.36000
   44    46    55    70.00000  124.00000
   44    47    48    70.00000  107.45700
   46    33    37    70.00000  112.99600
   46    33    38    70.00000  112.02700
   46    55    56    35.00000  109.50000
   46    55    57    35.00000  109.50000
   46    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   47    44    46    80.00000  121.38400
   70    65    66    37.50000  110.70000
   70    65    67    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   59    45    53    70.00000  120.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   49    43    45    70.00000  120.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    46  -0.62250  1.0 1.0
   24    29    33    46  -0.38450 -1.0 2.0
   24    29    33    46   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    37    40  -0.16000  1.0 1.0
   29    33    37    40  -0.03200 -1.0 2.0
   29    33    37    40   0.04500  1.0 3.0
   29    33    37    60  -0.16000  1.0 1.0
   29    33    37    60  -0.03200 -1.0 2.0
   29    33    37    60   0.04500  1.0 3.0
   29    33    38    67   0.44750  1.0 1.0
   29    33    38    67  -0.17800 -1.0 2.0
   29    33    38    67   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    46    44   0.42700  1.0 1.0
   29    33    46    44  -0.70350 -1.0 2.0
   29    33    46    44  -0.43150  1.0 3.0
   29    33    46    55   0.30250  1.0 1.0
   29    33    46    55  -0.14950 -1.0 2.0
   29    33    46    55   0.36900  1.0 3.0
   33    37    40    41   3.62500 -1.0 2.0
   33    37    40    43   3.62500 -1.0 2.0
   33    37    60    53   3.62500 -1.0 2.0
   33    37    60    65   3.62500 -1.0 2.0
   33    38   -42    44  -0.46850  1.0 1.0
   33    38   -42    44   0.09300 -1.0 2.0
   33    38   -42    44  -0.12850  1.0 3.0
   33    46    55    56   0.34800  1.0 3.0
   33    46    55    57   0.34800  1.0 3.0
   33    46    55    58   0.34800  1.0 3.0
   37    33    38    67  -0.03700  1.0 1.0
   37    33    38    67   0.37200 -1.0 2.0
   37    33    38    67  -0.47300  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    42  -0.64350  1.0 1.0
   37    33    38    42  -0.04200 -1.0 2.0
   37    33    38    42   0.19800  1.0 3.0
   37    33    46    44   1.44450  1.0 1.0
   37    33    46    44   0.06600 -1.0 2.0
   37    33    46    44   0.29250  1.0 3.0
   37    33    46    55   0.09700  1.0 1.0
   37    33    46    55   0.15600 -1.0 2.0
   37    33    46    55  -0.50800  1.0 3.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40    43    49   3.62500 -1.0 2.0
   37    60    65    66   0.00000  1.0 1.0
   37    60   -65    67   0.04150 -1.0 2.0
   37    60    65    70   0.04150 -1.0 2.0
   40    37    60    53   3.62500 -1.0 2.0
   40    37    60    65   3.62500 -1.0 2.0
   40    43   -45    53   3.62500 -1.0 2.0
   40    43    45    59   3.62500 -1.0 2.0
   40    43    49    50   0.00000  1.0 1.0
   40    43    49    51   0.00000  1.0 1.0
   40    43    49    52   0.00000  1.0 1.0
   41    40    43    45   3.62500 -1.0 2.0
   41    40    43    49   3.62500 -1.0 2.0
   43    45    53    54   3.62500 -1.0 2.0
   43    45    53    60   3.62500 -1.0 2.0
   43    45    59    61   1.63200 -1.0 2.0
   45    43    49    50   0.00000  1.0 1.0
   45    43    49    51   0.00000  1.0 1.0
   45    43    49    52   0.00000  1.0 1.0
   45    53   -60    37   3.62500 -1.0 2.0
   45    53    60    65   3.62500 -1.0 2.0
   45    59    61    62   0.08050  1.0 3.0
   45    59    61    63   0.08050  1.0 3.0
   45    59    61    64   0.08050  1.0 3.0
   53    45    59    61   1.63200 -1.0 2.0
   53    60    65    66   0.00000  1.0 1.0
   53    60    65    67   0.04150 -1.0 2.0
   53    60    65    70   0.04150 -1.0 2.0
   54    53    60    37   3.62500 -1.0 2.0
   54    53    60    65   3.62500 -1.0 2.0
   60    37    40    41   3.62500 -1.0 2.0
   60    37   -40    43   3.62500 -1.0 2.0
   60    65    67    68   0.43200  1.0 3.0
   60    65    67    69   0.43200  1.0 3.0
   60    65    67    38  -0.03700  1.0 1.0
   60    65    67    38   0.37200 -1.0 2.0
   60    65    67    38  -0.47300  1.0 3.0
   60    65    70    71   0.43200  1.0 3.0
   60    65    70    72   0.43200  1.0 3.0
   60    65    70    73   0.43200  1.0 3.0
   65    67   -38    33   0.56750  1.0 1.0
   65    67   -38    33  -0.07550 -1.0 2.0
   65    67   -38    33   0.20000  1.0 3.0
   65    67    38    39   0.15000  1.0 3.0
   65    67    38    42   0.62750  1.0 1.0
   65    67    38    42  -0.30950 -1.0 2.0
   65    67    38    42   0.27300  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    38   0.15000  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    72   0.15000  1.0 3.0
   66    65    70    73   0.15000  1.0 3.0
   67    65    70    71   0.15000  1.0 3.0
   67    65    70    72   0.15000  1.0 3.0
   67    65    70    73   0.15000  1.0 3.0
   67    38    42    44  -0.46850  1.0 1.0
   67    38    42    44   0.09300 -1.0 2.0
   67    38    42    44  -0.12850  1.0 3.0
   68    67    38    33   0.15000  1.0 3.0
   68    67    38    39   0.15000  1.0 3.0
   68    67    38    42   0.23400  1.0 3.0
   69    67    38    33   0.15000  1.0 3.0
   69    67    38    39   0.15000  1.0 3.0
   69    67    38    42   0.23400  1.0 3.0
   38    33    37    40   0.04150 -1.0 2.0
   38    33   -37    60   0.04150 -1.0 2.0
   38    33   -46    44   0.09850  1.0 1.0
   38    33   -46    44   0.15250 -1.0 2.0
   38    33   -46    44  -0.50650  1.0 3.0
   38    33    46    55   0.46850  1.0 1.0
   38    33    46    55   0.08550 -1.0 2.0
   38    33    46    55   0.09800  1.0 3.0
   38    42   -44    46  -2.26850  1.0 1.0
   38    42   -44    46   3.39050 -1.0 2.0
   38    42    44    47   2.00000 -1.0 2.0
   39    38    42    44   0.08050  1.0 3.0
   42    44   -46    33   7.00000 -1.0 2.0
   42    44    46    55   7.00000 -1.0 2.0
   42    44    47    48   2.00000 -1.0 2.0
   44    46    55    56   0.00000  1.0 1.0
   44    46    55    57   0.00000  1.0 1.0
   44    46    55    58   0.00000  1.0 1.0
   46    33    37    40   0.18050 -1.0 2.0
   46    33    37    60   0.18050 -1.0 2.0
   46    33    38    67   0.34400  1.0 1.0
   46    33    38    67   0.09450 -1.0 2.0
   46    33    38    67   0.11100  1.0 3.0
   46    33    38    39   0.15000  1.0 3.0
   46    33   -38    42   0.61850  1.0 1.0
   46    33   -38    42  -0.22750 -1.0 2.0
   46    33   -38    42   0.15300  1.0 3.0
   46    44    47    48  -0.66100  1.0 1.0
   46    44    47    48   1.20850 -1.0 2.0
   46    44    47    48  -0.36000  1.0 3.0
   47    44    46    33   7.00000 -1.0 2.0
   47    44    46    55   7.00000 -1.0 2.0
   70    65    67    68   0.15000  1.0 3.0
   70    65    67    69   0.15000  1.0 3.0
   70    65    67    38   0.56750  1.0 1.0
   70    65    67    38  -0.07550 -1.0 2.0
   70    65    67    38   0.20000  1.0 3.0
   59    45    53    54   3.62500 -1.0 2.0
   59    45    53    60   3.62500 -1.0 2.0
   49    43    45    53   3.62500 -1.0 2.0
   49    43    45    59   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   40    60    37    33   4.00000 -1.0 2.0
   43    41    40    37   1.10000 -1.0 2.0
   45    49    43    40   4.00000 -1.0 2.0
   53    59    45    43   4.00000 -1.0 2.0
   60    54    53    45   1.10000 -1.0 2.0
   53    65    60    37   4.00000 -1.0 2.0
   42    47    44    46   1.10000 -1.0 2.0
   33    55    46    44   1.10000 -1.0 2.0
END
