* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    134    218     401
    1     0 S   NP   _N1_     1    28.71079    95.79172   -23.71007
    2     1 S   H    _HN1     2     1.02950    75.74605    14.38505
    3     1 S   H    _H1_     3     1.02829    33.88293   171.56034
    4     1 S   H    _H2_     4     1.02785   106.59174   -90.89308
    5     1 S   CT   _CA1     5     1.50112   135.51132   119.13453
    6     5 S   HC   _HA1     6     1.09573   105.20022    87.42618
    7     5 S   CO3  _C1_     7     1.53791   112.46473   -32.81386
    8     7 S   O2Z  _O11     8     1.26372   115.00701   -42.43476
    9     7 S   O2Z  _O12     9     1.26241   114.94887   136.71591
   10     5 S   CT   _CB1    10     1.53084   107.42389  -154.58418
   11    10 S   HC   HB11    11     1.09832   109.37999   -49.73518
   12    10 S   HC   HB12    12     1.09813   110.44043    66.87541
   13    10 S   CT   _CG1    13     1.52987   112.60303  -170.71943
   14    13 S   HC   HG11    14     1.09583   110.61379   -65.39067
   15    13 S   HC   HG12    15     1.09670   109.80180    53.83860
   16    13 S   C    _CD1    16     1.51799   112.25625   174.29257
   17    16 S   O    _OE1    17     1.22728   123.30060     6.12698
   18    16 S   N    _N2_    18     1.38652   111.65170  -173.96896
   19    18 S   H    _HN2    19     1.01582   118.93644     1.74876
   20    18 S   CT1  _CA2    20     1.46190   123.39295   177.67864
   21    20 S   HC   _HA2    21     1.09737   109.37033     2.03192
   22    20 S   C    _C2_    22     1.53543   108.64826  -113.46031
   23    22 S   O    _O2_    23     1.23060   122.26350  -148.24720
   24    20 S   CT   _CB2    32     1.53351   111.55661   124.05130
   25    24 S   HC   HB21    33     1.09476   109.91122    56.29151
   26    24 S   HC   HB22    34     1.09512   110.11189   175.30848
   27    22 S   N    _N3_    24     1.38324   113.71333    39.21697
   28    27 S   H    _HN3    25     1.01588   119.58523    -3.37011
   29    24 S   S    _SG2    35     1.82808   111.45248   -65.01781
   30    27 S   CT   _CA3    26     1.45289   123.20650   177.11364
   31    30 S   HC   HA31    27     1.09550   107.51507   -64.41578
   32    30 S   HC   HA32    28     1.09558   107.97721    52.01914
   33    29 S   CT   _C16    36     1.84674    99.91651  -177.51848
   34    33 S   HC   _H3_    37     1.09838   106.32242    37.37656
   35    30 S   CO3  _C3_    29     1.52960   114.08558   174.00737
   36    35 S   O2Z  _O31    30     1.26375   116.06727    -0.75847
   37    35 S   O2Z  _O32    31     1.26429   114.41267   179.30339
   38    33 S   CT   _C10    38     1.53403   108.51272   -78.39781
   39    38 S   HC   _H24    39     1.09637   109.94397    64.02905
   40    38 S   HC   _H25    40     1.09619   112.26128   -55.50694
   41    38 S   CO4  _C6_    41     1.51153   112.62566  -177.03760
   42    41 S   O    _O16    42     1.22929   121.50004  -143.29042
   43    41 S   CM   _C4_    43     1.49220   116.81529    40.58296
   44    43 S   CT   _C13    44     1.51371   115.77557   -42.18773
   45    44 S   HC   _H30    45     1.10169   105.50333   -65.08596
   46    43 S   CM   _C8_    68     1.34090   116.07865   137.47258
   47    46 S   HC   _H20    69     1.08397   122.07222  -179.72305
   48    46 S   HC   _H21    70     1.08614   121.87450    -0.03956
   49    44 S   CT   _C11    46     1.53951   114.30805   179.20574
   50    49 S   HC   _H26    47     1.09779   110.13870   -59.88203
   51    49 S   HC   _H27    48     1.09897   109.65914    55.74659
   52    33 S   CT   _C17    60     1.57828   113.72348   154.72705
   53    49 S   CT   _C14    49     1.53260   112.62988   175.63987
   54    53 S   HC   _H31    50     1.09598   109.82512   -76.57474
   55    52 S   CT   _C18    61     1.55090   111.13844    60.50442
   56    55 S   HC   _H34    62     1.09403   112.27131    54.78792
   57    55 S   HC   _H35    63     1.09499   111.54560   -65.75644
   58    55 S   HC   _H36    64     1.09268   112.42753   174.79192
   59    53 S   CM   _C5_    51     1.48998   110.63206   158.19510
   60    59 S   CO4  _C7_    52     1.48091   108.13493   -93.22722
   61    60 S   O    _O17    53     1.21685   127.19284   167.83459
   62    59 S   CM   _C9_    65     1.33454   128.79584    88.35843
   63    62 S   HC   _H22    66     1.08487   120.76681    -0.95613
   64    62 S   HC   _H23    67     1.08506   121.61681   179.11089
   65    60 S   OS   _O18    54     1.36797   106.61634   -10.56649
   66    53 S   CT   _C15    55     1.51573   114.36367    47.92169
   67    66 S   HC   _H32    56     1.09999   110.30990  -162.65477
   68    66 S   CT   _C12    57     1.52685   115.30046   -40.89165
   69    68 S   HC   _H28    58     1.09670   108.18211   167.38129
   70    68 S   HC   _H29    59     1.09863   107.03454   -77.81670
  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  10   5   4   3
  19   8   2   1   1  10   5   4   9   3  12  19   8   4   1   1
  13   6   5  11  13   7   7   3   2   1   9   8   3   4   1   1
   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    52    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44    68    52    55  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    49    66    68    69    70    52    55    56    57    58  
   38    39    40    41    44    68    52    55  
   36    37  
   37  
    0  
   39    40    41    42    43    44    68    52    55    46  
   40    41    42    43    52  
   41    42    43    52  
   42    43    44    45    49    52    46    47    48  
   43    44    46  
   44    45    49    50    51    53    68    52    55    46    47    48  
   45    49    50    51    53    54    59    66    68    69    70    52    55    56    57    58    46    47    48  
   49    50    51    53    68    52    55    46  
   47    48    49    52  
   48  
    0  
   50    51    53    54    59    60    65    66    67    68    52    55    62  
   51    53    54    59    66    52  
   53    54    59    66    52  
   55    56    57    58    53    65    66    67    68    69    70  
   54    59    60    61    65    66    67    68    69    70    62    63    64  
   59    60    65    66    67    68    62  
   56    57    58    66    68    69    70  
   57    58    68  
   58    68  
   68  
   60    61    65    66    67    68    62    63    64  
   61    65    66    67    68    62    63    64  
   65    66    62  
   63    64    65    66  
   64  
    0  
   66    67    68    69    70  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   66   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   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
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   268.000  1.529
   33    52   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   320.000  1.462
   43    44   317.000  1.510
   43    46   549.000  1.340
   44    45   340.000  1.090
   44    49   268.000  1.529
   44    52   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    53   268.000  1.529
   53    54   340.000  1.090
   53    59   317.000  1.510
   53    66   268.000  1.529
   59    60   320.000  1.462
   59    62   549.000  1.340
   60    61   570.000  1.229
   60    65   214.000  1.327
   65    66   320.000  1.410
   66    67   340.000  1.090
   66    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    52   268.000  1.529
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   62    63   340.000  1.080
   62    64   340.000  1.080
   46    47   340.000  1.080
   46    48   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  111.63000
   29    33    52    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    52    44    58.35000  112.70000
   33    52    68    58.35000  112.70000
   33    52    55    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    65.00000  118.62400
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    43    44    65.00000  116.34900
   41    43    46    65.00000  118.96000
   43    41    42    80.00000  123.72100
   43    44    45    35.00000  109.50000
   43    44    49    70.00000  112.02700
   43    44    52    70.00000  112.02700
   43    46    47    35.00000  120.00000
   43    46    48    35.00000  120.00000
   44    49    50    37.50000  110.70000
   44    49    51    37.50000  110.70000
   44    49    53    58.35000  112.70000
   44    52    68    58.35000  112.70000
   44    52    55    58.35000  112.70000
   49    44    45    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    59    70.00000  112.02700
   49    53    66    58.35000  112.70000
   51    49    50    33.00000  107.80000
   53    49    50    37.50000  110.70000
   53    49    51    37.50000  110.70000
   53    59    60    65.00000  116.34900
   53    59    62    70.00000  124.00000
   53    66    65    50.00000  109.50000
   53    66    67    37.50000  110.70000
   53    66    68    58.35000  112.70000
   59    53    54    35.00000  109.50000
   59    60    61    80.00000  123.72100
   59    60    65    90.00000  111.29400
   59    62    63    35.00000  120.00000
   59    62    64    35.00000  120.00000
   60    65    66    83.00000  116.90000
   65    60    61    83.00000  123.40000
   65    66    67    35.00000  109.50000
   65    66    68    50.00000  109.50000
   66    53    54    37.50000  110.70000
   66    53    59    70.00000  112.02700
   66    68    69    37.50000  110.70000
   66    68    70    37.50000  110.70000
   66    68    52    58.35000  112.70000
   68    66    67    37.50000  110.70000
   68    52    55    58.35000  112.70000
   70    68    69    33.00000  107.80000
   52    33    34    37.50000  110.70000
   52    33    38    58.35000  112.70000
   52    44    45    37.50000  110.70000
   52    44    49    58.35000  112.70000
   52    68    69    37.50000  110.70000
   52    68    70    37.50000  110.70000
   52    55    56    37.50000  110.70000
   52    55    57    37.50000  110.70000
   52    55    58    37.50000  110.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   62    59    60    65.00000  118.96000
   64    62    63    35.00000  117.00000
   46    43    44    70.00000  124.00000
   48    46    47    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   0.01700  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    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    52    44   0.44750  1.0 1.0
   29    33    52    44  -0.17800 -1.0 2.0
   29    33    52    44   0.20200  1.0 3.0
   29    33    52    68   0.44750  1.0 1.0
   29    33    52    68  -0.17800 -1.0 2.0
   29    33    52    68   0.20200  1.0 3.0
   29    33    52    55   0.44750  1.0 1.0
   29    33    52    55  -0.17800 -1.0 2.0
   29    33    52    55   0.20200  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   0.65300  1.0 1.0
   33    38    41    43  -0.03850 -1.0 2.0
   33    38    41    43   0.33900  1.0 3.0
   33    52    55    56   0.15000  1.0 3.0
   33    52    55    57   0.15000  1.0 3.0
   33    52    55    58   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    52    44   0.15000  1.0 3.0
   34    33    52    68   0.15000  1.0 3.0
   34    33    52    55   0.15000  1.0 3.0
   38    33    52    44   0.56750  1.0 1.0
   38    33    52    44  -0.07550 -1.0 2.0
   38    33    52    44   0.20000  1.0 3.0
   38    33    52    68   0.56750  1.0 1.0
   38    33    52    68  -0.07550 -1.0 2.0
   38    33    52    68   0.20000  1.0 3.0
   38    33    52    55   0.56750  1.0 1.0
   38    33    52    55  -0.07550 -1.0 2.0
   38    33    52    55   0.20000  1.0 3.0
   38    41   -43    44   0.25700  1.0 1.0
   38    41   -43    44   0.66200 -1.0 2.0
   38    41   -43    44   0.04450  1.0 3.0
   38    41    43    46  -0.33500  1.0 1.0
   38    41    43    46   1.06600 -1.0 2.0
   38    41    43    46  -0.14000  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    44    45   0.15000  1.0 3.0
   41    43    44    49   0.09700  1.0 1.0
   41    43    44    49   0.15600 -1.0 2.0
   41    43    44    49  -0.50800  1.0 3.0
   41    43    44    52   0.09700  1.0 1.0
   41    43    44    52   0.15600 -1.0 2.0
   41    43    44    52  -0.50800  1.0 3.0
   41    43    46    47   7.00000 -1.0 2.0
   41    43    46    48   7.00000 -1.0 2.0
   42    41    43    44  -0.64400  1.0 1.0
   42    41    43    44   0.26850 -1.0 2.0
   42    41    43    46   1.00000 -1.0 2.0
   43    44    49    50   0.15000  1.0 3.0
   43    44    49    51   0.15000  1.0 3.0
   43    44    49    53   0.34400  1.0 1.0
   43    44    49    53   0.09450 -1.0 2.0
   43    44    49    53   0.11100  1.0 3.0
   43    44   -52    33   0.34400  1.0 1.0
   43    44   -52    33   0.09450 -1.0 2.0
   43    44   -52    33   0.11100  1.0 3.0
   43    44    52    68   0.34400  1.0 1.0
   43    44    52    68   0.09450 -1.0 2.0
   43    44    52    68   0.11100  1.0 3.0
   43    44    52    55   0.34400  1.0 1.0
   43    44    52    55   0.09450 -1.0 2.0
   43    44    52    55   0.11100  1.0 3.0
   44    43    46    47   7.00000 -1.0 2.0
   44    43    46    48   7.00000 -1.0 2.0
   44    49    53    54   0.15000  1.0 3.0
   44    49    53    59   0.34400  1.0 1.0
   44    49    53    59   0.09450 -1.0 2.0
   44    49    53    59   0.11100  1.0 3.0
   44    49    53    66   0.56750  1.0 1.0
   44    49    53    66  -0.07550 -1.0 2.0
   44    49    53    66   0.20000  1.0 3.0
   44    52    55    56   0.15000  1.0 3.0
   44    52    55    57   0.15000  1.0 3.0
   44    52    55    58   0.15000  1.0 3.0
   45    44    49    50   0.15000  1.0 3.0
   45    44    49    51   0.15000  1.0 3.0
   45    44    49    53   0.15000  1.0 3.0
   45    44    52    33   0.15000  1.0 3.0
   45    44    52    68   0.15000  1.0 3.0
   45    44    52    55   0.15000  1.0 3.0
   49    44    52    33   0.56750  1.0 1.0
   49    44    52    33  -0.07550 -1.0 2.0
   49    44    52    33   0.20000  1.0 3.0
   49    44    52    68   0.56750  1.0 1.0
   49    44    52    68  -0.07550 -1.0 2.0
   49    44    52    68   0.20000  1.0 3.0
   49    44    52    55   0.56750  1.0 1.0
   49    44    52    55  -0.07550 -1.0 2.0
   49    44    52    55   0.20000  1.0 3.0
   49    53    59    60   0.09700  1.0 1.0
   49    53    59    60   0.15600 -1.0 2.0
   49    53    59    60  -0.50800  1.0 3.0
   49    53    59    62   0.09850  1.0 1.0
   49    53    59    62   0.15250 -1.0 2.0
   49    53    59    62  -0.50650  1.0 3.0
   49    53    66    65   0.62750  1.0 1.0
   49    53    66    65  -0.30950 -1.0 2.0
   49    53    66    65   0.27300  1.0 3.0
   49    53    66    67   0.15000  1.0 3.0
   49    53   -66    68   0.56750  1.0 1.0
   49    53   -66    68  -0.07550 -1.0 2.0
   49    53   -66    68   0.20000  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    59   0.15000  1.0 3.0
   50    49    53    66   0.15000  1.0 3.0
   51    49    53    54   0.15000  1.0 3.0
   51    49    53    59   0.15000  1.0 3.0
   51    49    53    66   0.15000  1.0 3.0
   53    59    60    61  -0.64400  1.0 1.0
   53    59    60    61   0.26850 -1.0 2.0
   53    59   -60    65  -0.15000  1.0 1.0
   53    59   -60    65   0.89550 -1.0 2.0
   53    59   -60    65  -0.06900  1.0 3.0
   53    59    62    63   7.00000 -1.0 2.0
   53    59    62    64   7.00000 -1.0 2.0
   53    66    68    69   0.15000  1.0 3.0
   53    66    68    70   0.15000  1.0 3.0
   53    66    68    52   0.56750  1.0 1.0
   53    66    68    52  -0.07550 -1.0 2.0
   53    66    68    52   0.20000  1.0 3.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    62   0.00000  1.0 1.0
   54    53    66    65   0.23400  1.0 3.0
   54    53    66    67   0.15000  1.0 3.0
   54    53    66    68   0.15000  1.0 3.0
   59    53   -66    65   0.61850  1.0 1.0
   59    53   -66    65  -0.22750 -1.0 2.0
   59    53   -66    65   0.15300  1.0 3.0
   59    53    66    67   0.15000  1.0 3.0
   59    53    66    68   0.34400  1.0 1.0
   59    53    66    68   0.09450 -1.0 2.0
   59    53    66    68   0.11100  1.0 3.0
   59    60   -65    66   2.00000 -1.0 2.0
   60    59    62    63   7.00000 -1.0 2.0
   60    59    62    64   7.00000 -1.0 2.0
   60    65   -66    53  -0.25900  1.0 1.0
   60    65   -66    53  -0.47000 -1.0 2.0
   60    65   -66    53   0.11750  1.0 3.0
   60    65    66    67   0.08050  1.0 3.0
   60    65    66    68  -0.25900  1.0 1.0
   60    65    66    68  -0.47000 -1.0 2.0
   60    65    66    68   0.11750  1.0 3.0
   61    60    65    66   3.00000 -1.0 2.0
   65    66    68    69   0.23400  1.0 3.0
   65    66    68    70   0.23400  1.0 3.0
   65    66    68    52   0.62750  1.0 1.0
   65    66    68    52  -0.30950 -1.0 2.0
   65    66    68    52   0.27300  1.0 3.0
   66    53   -59    60   0.09700  1.0 1.0
   66    53   -59    60   0.15600 -1.0 2.0
   66    53   -59    60  -0.50800  1.0 3.0
   66    53    59    62   0.09850  1.0 1.0
   66    53    59    62   0.15250 -1.0 2.0
   66    53    59    62  -0.50650  1.0 3.0
   66    68    52    33   0.56750  1.0 1.0
   66    68    52    33  -0.07550 -1.0 2.0
   66    68    52    33   0.20000  1.0 3.0
   66    68   -52    44   0.56750  1.0 1.0
   66    68   -52    44  -0.07550 -1.0 2.0
   66    68   -52    44   0.20000  1.0 3.0
   66    68    52    55   0.56750  1.0 1.0
   66    68    52    55  -0.07550 -1.0 2.0
   66    68    52    55   0.20000  1.0 3.0
   67    66    68    69   0.15000  1.0 3.0
   67    66    68    70   0.15000  1.0 3.0
   67    66    68    52   0.15000  1.0 3.0
   68    52    55    56   0.15000  1.0 3.0
   68    52    55    57   0.15000  1.0 3.0
   68    52    55    58   0.15000  1.0 3.0
   69    68    52    33   0.15000  1.0 3.0
   69    68    52    44   0.15000  1.0 3.0
   69    68    52    55   0.15000  1.0 3.0
   70    68    52    33   0.15000  1.0 3.0
   70    68    52    44   0.15000  1.0 3.0
   70    68    52    55   0.15000  1.0 3.0
   52    33    38    39   0.15000  1.0 3.0
   52    33    38    40   0.15000  1.0 3.0
   52    33   -38    41  -0.95700  1.0 1.0
   52    33   -38    41  -0.18200 -1.0 2.0
   52    33   -38    41   0.29450  1.0 3.0
   52    44    49    50   0.15000  1.0 3.0
   52    44    49    51   0.15000  1.0 3.0
   52    44   -49    53   0.56750  1.0 1.0
   52    44   -49    53  -0.07550 -1.0 2.0
   52    44   -49    53   0.20000  1.0 3.0
   62    59    60    61   1.00000 -1.0 2.0
   62    59    60    65  -0.56150  1.0 1.0
   62    59    60    65   2.19150 -1.0 2.0
   46    43    44    45   0.00000  1.0 1.0
   46    43    44    49   0.09850  1.0 1.0
   46    43    44    49   0.15250 -1.0 2.0
   46    43    44    49  -0.50650  1.0 3.0
   46    43    44    52   0.09850  1.0 1.0
   46    43    44    52   0.15250 -1.0 2.0
   46    43    44    52  -0.50650  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   38    43    41    42  10.50000 -1.0 2.0
   41    44    43    46   1.10000 -1.0 2.0
   53    60    59    62   1.10000 -1.0 2.0
   59    65    60    61  10.50000 -1.0 2.0
   63    64    62    59   1.10000 -1.0 2.0
   47    48    46    43   1.10000 -1.0 2.0
END
