* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    140    226     419
    1     0 S   NP   _N1_     1    28.58191    94.78104   -21.50296
    2     1 S   H    _HN1     2     1.02778    89.95191   -72.90697
    3     1 S   H    _H1_     3     1.02962    90.29488    35.40694
    4     1 S   H    _H2_     4     1.02837    30.64395   159.92343
    5     1 S   CT   _CA1     5     1.50107   141.40165   159.83019
    6     5 S   HC   _HA1     6     1.09572   105.26480    59.22814
    7     5 S   CO3  _C1_     7     1.53817   112.36053   -61.04865
    8     7 S   O2Z  _O11     8     1.26359   115.02156   -44.63281
    9     7 S   O2Z  _O12     9     1.26239   114.92104   134.60654
   10     5 S   CT   _CB1    10     1.53097   107.43402   177.16883
   11    10 S   HC   HB11    11     1.09821   109.42599   -50.68218
   12    10 S   HC   HB12    12     1.09824   110.36816    65.88283
   13    10 S   CT   _CG1    13     1.52998   112.64745  -171.80142
   14    13 S   HC   HG11    14     1.09605   110.37069   -61.59686
   15    13 S   HC   HG12    15     1.09636   110.09415    57.63287
   16    13 S   C    _CD1    16     1.51791   112.27590   178.02682
   17    16 S   O    _OE1    17     1.22714   123.27280    -6.51927
   18    16 S   N    _N2_    18     1.38602   111.59386   173.62834
   19    18 S   H    _HN2    19     1.01586   119.00327     1.88242
   20    18 S   CT1  _CA2    20     1.46249   123.43332  -177.48238
   21    20 S   HC   _HA2    21     1.09730   109.46867   -12.24902
   22    20 S   C    _C2_    22     1.53408   108.22410  -128.05567
   23    22 S   O    _O2_    23     1.23008   122.25833  -144.84908
   24    20 S   CT   _CB2    32     1.53683   111.22099   109.88970
   25    24 S   HC   HB21    33     1.09206   108.75074    55.89629
   26    24 S   HC   HB22    34     1.09423   109.80655   174.48360
   27    22 S   N    _N3_    24     1.38509   113.33017    42.38344
   28    27 S   H    _HN3    25     1.01530   118.91079    -0.59116
   29    24 S   S    _SG2    35     1.82900   111.08879   -66.10255
   30    27 S   CT   _CA3    26     1.45460   123.51438   175.25591
   31    30 S   HC   HA31    27     1.09518   109.31922    22.48892
   32    30 S   HC   HA32    28     1.09498   107.09054   139.50309
   33    29 S   CT   _C14    36     1.89884   104.75111   166.31647
   34    30 S   CO3  _C3_    29     1.52925   113.10381  -101.05336
   35    34 S   O2Z  _O31    30     1.26403   115.40608   -44.15476
   36    34 S   O2Z  _O32    31     1.26355   114.98265   136.79226
   37    33 S   CT   _C13    37     1.58120   105.28894   152.55792
   38    37 S   HC   _H5_    38     1.09702   109.29827   176.98312
   39    33 S   CT   _C15    59     1.55410   110.78677    29.68583
   40    39 S   HC   _H6_    60     1.09526   108.93484   -60.15002
   41    37 S   CO4  _C12    39     1.53366   111.05852    63.30382
   42    41 S   O    _O33    40     1.22976   123.30439  -144.38612
   43    37 S   CT   _C17    69     1.53585   116.88585   -63.87677
   44    43 S   HC   _H16    70     1.09336   112.74560    56.97971
   45    43 S   HC   _H17    71     1.09210   111.66394   -65.91941
   46    43 S   HC   _H18    72     1.09655   110.68212   176.46100
   47    41 S   CM   _C11    41     1.47944   117.97754    39.20716
   48    47 S   HC   _H15    42     1.08376   117.83711   170.18598
   49    47 S   CM   _C10    43     1.33620   120.54801    -8.44871
   50    49 S   HC   _H14    44     1.08920   117.17116   177.10004
   51    33 S   CT   _C9_    45     1.60756   111.91109   -90.43322
   52    51 S   CT   _C8_    46     1.56955   111.16467   171.63243
   53    52 S   HC   _H12    47     1.09859   110.19085  -172.81389
   54    52 S   HC   _H13    48     1.09836   109.94674    71.67336
   55    51 S   CT   _C18    65     1.54995   113.57549    50.55424
   56    55 S   HC   _H19    66     1.09301   112.45211    56.79742
   57    55 S   HC   _H20    67     1.09502   112.36011   -65.78972
   58    55 S   HC   _H21    68     1.09791   111.01193   175.70573
   59    52 S   CT   _C7_    49     1.53570   114.58849   -50.20792
   60    59 S   HC   _H10    50     1.09597   109.58126   174.51248
   61    59 S   HC   _H11    51     1.09556   109.51333   -68.63972
   62    59 S   CT   _C6_    52     1.51719   109.57933    53.68734
   63    62 S   HC   _H4_    53     1.09829   108.47040    62.00404
   64    62 S   CT   _C5_    54     1.52212   119.99342  -176.48164
   65    64 S   HC   _H3_    55     1.09559   109.60831   -89.76646
   66    64 S   CO4  _C16    56     1.51644   100.27969   155.57069
   67    66 S   O    _O35    57     1.22135   125.53130   163.84713
   68    64 S   CT   _C4_    61     1.51983   116.48197    36.18412
   69    68 S   HC   _H7_    62     1.09490   112.18828    56.07643
   70    68 S   HC   _H8_    63     1.09439   110.98951   -65.30650
   71    68 S   HC   _H9_    64     1.09564   110.39130   175.30723
   72    66 S   OS   _O34    58     1.37497   110.17984   -16.52016
  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  13   5   4   3
  27   2   1   1  17   9  18   7  10   4   5   2   1   1   6   3
  10   3  12  12   6   5   4   2   1   1   9   4   3  10   5   8
   7   6   2   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    49    51    52    62    72    39    40    55    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    47    49    50    51    52    53    54    59    62    63    64    66    72    39    40    55    56    57    58    43    44    45    46  
   35    36  
   36  
    0  
   38    41    42    47    48    49    51    52    62    72    39    40    55    43    44    45    46  
   41    42    47    51    39    43    44    45    46  
   40    68    55    43    41    49    51    52    59    60    61    62    63    64    65    66    67    72  
   51    59    62    63    64    66    72  
   42    47    48    49    50    51    43    44    45    46  
   47    48    49    43  
   44    45    46    47    51  
   45    46  
   46  
    0  
   48    49    50    51    52    55  
   49    50    51  
   50    51    52    53    54    59    55    56    57    58  
   51    52    55  
   52    53    54    59    60    61    62    72    55    56    57    58  
   53    54    59    60    61    62    63    64    55    56    57    58  
   54    59    60    61    62    55  
   59    60    61    62    55  
   56    57    58    59  
   57    58  
   58  
    0  
   60    61    62    63    64    65    66    72    68  
   61    62    63    64  
   62    63    64  
   63    64    65    66    67    72    68    69    70    71  
   64    65    66    72    68  
   65    66    67    72    68    69    70    71  
   66    67    72    68    69    70    71  
   67    72    68    69    70    71  
   72    68  
   69    70    71    72  
   70    71  
   71  
    0  
    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   0.167500   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   66   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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   268.000  1.529
   33    51   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   317.000  1.522
   37    43   268.000  1.529
   41    42   570.000  1.229
   41    47   320.000  1.462
   47    48   340.000  1.080
   47    49   549.000  1.340
   49    50   340.000  1.080
   49    51   317.000  1.510
   51    52   268.000  1.529
   51    55   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   268.000  1.529
   62    39   268.000  1.529
   64    65   340.000  1.090
   64    66   317.000  1.522
   64    68   268.000  1.529
   66    67   570.000  1.229
   66    72   214.000  1.327
   72    39   320.000  1.410
   39    40   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   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    75.00000  111.63000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    37    43    58.35000  112.70000
   33    51    49    70.00000  112.02700
   33    51    52    58.35000  112.70000
   33    51    55    58.35000  112.70000
   33    39    62    58.35000  112.70000
   33    39    72    50.00000  109.50000
   33    39    40    37.50000  110.70000
   37    41    42    80.00000  120.40000
   37    41    47    65.00000  118.62400
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    46    37.50000  110.70000
   41    37    38    35.00000  109.50000
   41    47    48    40.00000  117.72500
   41    47    49    65.00000  118.96000
   47    41    42    80.00000  123.72100
   47    49    50    35.00000  120.00000
   47    49    51    70.00000  124.00000
   49    47    48    35.00000  120.00000
   49    51    52    70.00000  112.02700
   49    51    55    70.00000  112.02700
   51    33    37    58.35000  112.70000
   51    49    50    35.00000  117.00000
   51    52    53    37.50000  110.70000
   51    52    54    37.50000  110.70000
   51    52    59    58.35000  112.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   52    59    60    37.50000  110.70000
   52    59    61    37.50000  110.70000
   52    59    62    58.35000  112.70000
   54    52    53    33.00000  107.80000
   59    52    53    37.50000  110.70000
   59    52    54    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    64    58.35000  112.70000
   59    62    39    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    64    65    37.50000  110.70000
   62    64    66    63.00000  111.10000
   62    64    68    58.35000  112.70000
   62    39    72    50.00000  109.50000
   62    39    40    37.50000  110.70000
   64    62    63    37.50000  110.70000
   64    66    67    80.00000  120.40000
   64    66    72    81.00000  111.40000
   64    68    69    37.50000  110.70000
   64    68    70    37.50000  110.70000
   64    68    71    37.50000  110.70000
   66    64    65    35.00000  109.50000
   66    72    39    83.00000  116.90000
   72    66    67    83.00000  123.40000
   72    39    40    35.00000  109.50000
   39    33    37    58.35000  112.70000
   39    33    51    58.35000  112.70000
   39    62    63    37.50000  110.70000
   39    62    64    58.35000  112.70000
   68    64    65    37.50000  110.70000
   68    64    66    63.00000  111.10000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   55    51    52    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   43    37    38    37.50000  110.70000
   43    37    41    63.00000  111.10000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    41   0.56750  1.0 1.0
   29    33    37    41  -0.07550 -1.0 2.0
   29    33    37    41   0.20000  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    51    49   0.56750  1.0 1.0
   29    33    51    49  -0.07550 -1.0 2.0
   29    33    51    49   0.20000  1.0 3.0
   29    33    51    52   0.44750  1.0 1.0
   29    33    51    52  -0.17800 -1.0 2.0
   29    33    51    52   0.20200  1.0 3.0
   29    33    51    55   0.44750  1.0 1.0
   29    33    51    55  -0.17800 -1.0 2.0
   29    33    51    55   0.20200  1.0 3.0
   29    33    39    62   0.44750  1.0 1.0
   29    33    39    62  -0.17800 -1.0 2.0
   29    33    39    62   0.20200  1.0 3.0
   29    33    39    72   0.56750  1.0 1.0
   29    33    39    72  -0.07550 -1.0 2.0
   29    33    39    72   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   33    37    41    42   0.30150 -1.0 2.0
   33    37    41    47   0.65300  1.0 1.0
   33    37    41    47  -0.03850 -1.0 2.0
   33    37    41    47   0.33900  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    46   0.15000  1.0 3.0
   33    51    52    53   0.15000  1.0 3.0
   33    51    52    54   0.15000  1.0 3.0
   33    51    52    59   0.56750  1.0 1.0
   33    51    52    59  -0.07550 -1.0 2.0
   33    51    52    59   0.20000  1.0 3.0
   33    51    55    56   0.15000  1.0 3.0
   33    51    55    57   0.15000  1.0 3.0
   33    51    55    58   0.15000  1.0 3.0
   37    33    51    49   0.34400  1.0 1.0
   37    33    51    49   0.09450 -1.0 2.0
   37    33    51    49   0.11100  1.0 3.0
   37    33    51    52   0.56750  1.0 1.0
   37    33    51    52  -0.07550 -1.0 2.0
   37    33    51    52   0.20000  1.0 3.0
   37    33    51    55   0.56750  1.0 1.0
   37    33    51    55  -0.07550 -1.0 2.0
   37    33    51    55   0.20000  1.0 3.0
   37    33    39    62   0.56750  1.0 1.0
   37    33    39    62  -0.07550 -1.0 2.0
   37    33    39    62   0.20000  1.0 3.0
   37    33    39    72   0.62750  1.0 1.0
   37    33    39    72  -0.30950 -1.0 2.0
   37    33    39    72   0.27300  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    41    47    48   0.04550  1.0 1.0
   37    41    47    48   0.83000 -1.0 2.0
   37    41    47    48  -0.04000  1.0 3.0
   37    41   -47    49  -0.33500  1.0 1.0
   37    41   -47    49   1.06600 -1.0 2.0
   37    41   -47    49  -0.14000  1.0 3.0
   38    37    41    42   0.00000  1.0 1.0
   38    37    41    47   0.00000  1.0 1.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37    43    46   0.15000  1.0 3.0
   41    37    43    44  -0.11250  1.0 3.0
   41    37    43    45  -0.11250  1.0 3.0
   41    37    43    46  -0.11250  1.0 3.0
   41    47    49    50   7.00000 -1.0 2.0
   41    47    49    51   7.00000 -1.0 2.0
   42    41    47    48   0.00000  1.0 1.0
   42    41    47    49   1.00000 -1.0 2.0
   47    49   -51    33   0.09850  1.0 1.0
   47    49   -51    33   0.15250 -1.0 2.0
   47    49   -51    33  -0.50650  1.0 3.0
   47    49    51    52   0.09850  1.0 1.0
   47    49    51    52   0.15250 -1.0 2.0
   47    49    51    52  -0.50650  1.0 3.0
   47    49    51    55   0.09850  1.0 1.0
   47    49    51    55   0.15250 -1.0 2.0
   47    49    51    55  -0.50650  1.0 3.0
   48    47    49    50   7.00000 -1.0 2.0
   48    47    49    51   7.00000 -1.0 2.0
   49    51    52    53   0.15000  1.0 3.0
   49    51    52    54   0.15000  1.0 3.0
   49    51    52    59   0.34400  1.0 1.0
   49    51    52    59   0.09450 -1.0 2.0
   49    51    52    59   0.11100  1.0 3.0
   49    51    55    56   0.15000  1.0 3.0
   49    51    55    57   0.15000  1.0 3.0
   49    51    55    58   0.15000  1.0 3.0
   50    49    51    33   0.00000  1.0 1.0
   50    49    51    52   0.00000  1.0 1.0
   50    49    51    55   0.00000  1.0 1.0
   51    33    37    38   0.15000  1.0 3.0
   51    33   -37    41  -0.95700  1.0 1.0
   51    33   -37    41  -0.18200 -1.0 2.0
   51    33   -37    41   0.29450  1.0 3.0
   51    33    37    43   0.56750  1.0 1.0
   51    33    37    43  -0.07550 -1.0 2.0
   51    33    37    43   0.20000  1.0 3.0
   51    33    39    62   0.56750  1.0 1.0
   51    33    39    62  -0.07550 -1.0 2.0
   51    33    39    62   0.20000  1.0 3.0
   51    33    39    72   0.62750  1.0 1.0
   51    33    39    72  -0.30950 -1.0 2.0
   51    33    39    72   0.27300  1.0 3.0
   51    33    39    40   0.15000  1.0 3.0
   51    52    59    60   0.15000  1.0 3.0
   51    52    59    61   0.15000  1.0 3.0
   51    52   -59    62   0.56750  1.0 1.0
   51    52   -59    62  -0.07550 -1.0 2.0
   51    52   -59    62   0.20000  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    57   0.15000  1.0 3.0
   52    51    55    58   0.15000  1.0 3.0
   52    59    62    63   0.15000  1.0 3.0
   52    59    62    64   0.56750  1.0 1.0
   52    59    62    64  -0.07550 -1.0 2.0
   52    59    62    64   0.20000  1.0 3.0
   52    59    62    39   0.56750  1.0 1.0
   52    59    62    39  -0.07550 -1.0 2.0
   52    59    62    39   0.20000  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    61   0.15000  1.0 3.0
   53    52    59    62   0.15000  1.0 3.0
   54    52    59    60   0.15000  1.0 3.0
   54    52    59    61   0.15000  1.0 3.0
   54    52    59    62   0.15000  1.0 3.0
   59    62    64    65   0.15000  1.0 3.0
   59    62    64    66  -0.95700  1.0 1.0
   59    62    64    66  -0.18200 -1.0 2.0
   59    62    64    66   0.29450  1.0 3.0
   59    62    64    68   0.56750  1.0 1.0
   59    62    64    68  -0.07550 -1.0 2.0
   59    62    64    68   0.20000  1.0 3.0
   59    62   -39    33   0.56750  1.0 1.0
   59    62   -39    33  -0.07550 -1.0 2.0
   59    62   -39    33   0.20000  1.0 3.0
   59    62    39    72   0.62750  1.0 1.0
   59    62    39    72  -0.30950 -1.0 2.0
   59    62    39    72   0.27300  1.0 3.0
   59    62    39    40   0.15000  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    64   0.15000  1.0 3.0
   60    59    62    39   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    64   0.15000  1.0 3.0
   61    59    62    39   0.15000  1.0 3.0
   62    64    66    67   0.30150 -1.0 2.0
   62    64   -66    72   0.36750  1.0 3.0
   62    64    68    69   0.15000  1.0 3.0
   62    64    68    70   0.15000  1.0 3.0
   62    64    68    71   0.15000  1.0 3.0
   63    62    64    65   0.15000  1.0 3.0
   63    62    64    66  -0.11250  1.0 3.0
   63    62    64    68   0.15000  1.0 3.0
   63    62    39    33   0.15000  1.0 3.0
   63    62    39    72   0.23400  1.0 3.0
   63    62    39    40   0.15000  1.0 3.0
   64    62    39    33   0.56750  1.0 1.0
   64    62    39    33  -0.07550 -1.0 2.0
   64    62    39    33   0.20000  1.0 3.0
   64    62   -39    72   0.62750  1.0 1.0
   64    62   -39    72  -0.30950 -1.0 2.0
   64    62   -39    72   0.27300  1.0 3.0
   64    62    39    40   0.15000  1.0 3.0
   64    66   -72    39   1.63150  1.0 1.0
   64    66   -72    39   2.92000 -1.0 2.0
   65    64    66    67   0.00000  1.0 1.0
   65    64    66    72   0.00000  1.0 1.0
   65    64    68    69   0.15000  1.0 3.0
   65    64    68    70   0.15000  1.0 3.0
   65    64    68    71   0.15000  1.0 3.0
   66    64    68    69  -0.11250  1.0 3.0
   66    64    68    70  -0.11250  1.0 3.0
   66    64    68    71  -0.11250  1.0 3.0
   66    72    39    33  -0.25900  1.0 1.0
   66    72    39    33  -0.47000 -1.0 2.0
   66    72    39    33   0.11750  1.0 3.0
   66    72   -39    62  -0.25900  1.0 1.0
   66    72   -39    62  -0.47000 -1.0 2.0
   66    72   -39    62   0.11750  1.0 3.0
   66    72    39    40   0.08050  1.0 3.0
   67    66    72    39   3.00000 -1.0 2.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41  -0.95700  1.0 1.0
   39    33    37    41  -0.18200 -1.0 2.0
   39    33    37    41   0.29450  1.0 3.0
   39    33    37    43   0.56750  1.0 1.0
   39    33    37    43  -0.07550 -1.0 2.0
   39    33    37    43   0.20000  1.0 3.0
   39    33    51    49   0.34400  1.0 1.0
   39    33    51    49   0.09450 -1.0 2.0
   39    33    51    49   0.11100  1.0 3.0
   39    33   -51    52   0.56750  1.0 1.0
   39    33   -51    52  -0.07550 -1.0 2.0
   39    33   -51    52   0.20000  1.0 3.0
   39    33    51    55   0.56750  1.0 1.0
   39    33    51    55  -0.07550 -1.0 2.0
   39    33    51    55   0.20000  1.0 3.0
   39    62    64    65   0.15000  1.0 3.0
   39    62   -64    66  -0.95700  1.0 1.0
   39    62   -64    66  -0.18200 -1.0 2.0
   39    62   -64    66   0.29450  1.0 3.0
   39    62    64    68   0.56750  1.0 1.0
   39    62    64    68  -0.07550 -1.0 2.0
   39    62    64    68   0.20000  1.0 3.0
   68    64    66    67   0.30150 -1.0 2.0
   68    64    66    72   0.36750  1.0 3.0
   55    51    52    53   0.15000  1.0 3.0
   55    51    52    54   0.15000  1.0 3.0
   55    51    52    59   0.56750  1.0 1.0
   55    51    52    59  -0.07550 -1.0 2.0
   55    51    52    59   0.20000  1.0 3.0
   43    37    41    42   0.30150 -1.0 2.0
   43    37    41    47   0.65300  1.0 1.0
   43    37    41    47  -0.03850 -1.0 2.0
   43    37    41    47   0.33900  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
   35    30    34    36  10.50000 -1.0 2.0
   37    47    41    42  10.50000 -1.0 2.0
   41    48    47    49   1.10000 -1.0 2.0
   51    50    49    47   1.10000 -1.0 2.0
   64    72    66    67  10.50000 -1.0 2.0
END
