* LIGAND DATABASE FILE (OPLS2005)
*
001      73    76    145    237     427
    1     0 S   NP   _N1_     1    30.64225    99.79218   -24.96507
    2     1 S   H    _HN1     2     1.03480   160.16990  -108.22748
    3     1 S   H    _H1_     3     1.02849    58.13659   -58.12599
    4     1 S   H    _H2_     4     1.02749    67.54163   172.31801
    5     1 S   CT   _CA1     5     1.50098    87.59265    58.35354
    6     5 S   HC   _HA1     6     1.09546   104.87009   124.14877
    7     5 S   CO3  _C1_     7     1.53673   113.31866     3.55490
    8     7 S   O2Z  _O11     8     1.26407   115.09175   -32.23338
    9     7 S   O2Z  _O12     9     1.26240   115.03838   147.11078
   10     5 S   CT   _CB1    10     1.53013   107.42099  -117.40251
   11    10 S   HC   HB11    11     1.09547   109.46789   -39.40453
   12    10 S   HC   HB12    12     1.09838   110.42751    76.18504
   13    10 S   CT   _CG1    13     1.53237   112.99940  -161.98082
   14    13 S   HC   HG11    14     1.09548   110.89504   -95.03919
   15    13 S   HC   HG12    15     1.09605   111.59734    24.24060
   16    13 S   C    _CD1    16     1.51546   109.31258   144.96385
   17    16 S   O    _OE1    17     1.22810   121.81043    85.77572
   18    16 S   N    _N2_    18     1.38546   112.52216   -90.84030
   19    18 S   H    _HN2    19     1.01592   119.18201    -5.53562
   20    18 S   CT1  _CA2    20     1.46175   123.62908   173.74198
   21    20 S   HC   _HA2    21     1.09705   109.23915    -7.30941
   22    20 S   C    _C2_    22     1.53835   109.18209  -123.23036
   23    22 S   O    _O2_    23     1.23102   121.97038  -158.63130
   24    20 S   CT   _CB2    32     1.53446   111.56874   115.02981
   25    24 S   HC   HB21    33     1.09432   109.39100    58.39850
   26    24 S   HC   HB22    34     1.09506   110.12859   176.52904
   27    22 S   N    _N3_    24     1.38301   114.20122    27.83719
   28    27 S   H    _HN3    25     1.01431   119.07880    -2.27942
   29    24 S   S    _SG2    35     1.82884   111.71328   -64.17000
   30    27 S   CT   _CA3    26     1.45316   123.40878   178.21304
   31    30 S   HC   HA31    27     1.09553   107.22782   -69.32926
   32    30 S   HC   HA32    28     1.09558   108.18700    47.00346
   33    29 S   CT   _C14    36     1.87076   101.37752   156.11545
   34    30 S   CO3  _C3_    29     1.53037   114.41979   169.07623
   35    34 S   O2Z  _O31    30     1.26429   116.36131    -6.28656
   36    34 S   O2Z  _O32    31     1.26415   114.42987   173.82714
   37    33 S   CT   _C10    37     1.59474   110.52974  -179.69674
   38    37 S   HC   _H5_    38     1.10159   106.56479    43.65540
   39    33 S   CT   _C15    70     1.54853   107.08839    59.78193
   40    39 S   HC   _H15    71     1.09550   111.90472   -67.72770
   41    39 S   HC   _H16    72     1.09403   111.31252   173.73941
   42    39 S   HC   _H17    73     1.09538   112.36251    53.21813
   43    37 S   CT   _C9_    39     1.53602   116.65611   -75.03888
   44    43 S   HC   _H4_    40     1.09341   111.17224   -60.74881
   45    37 S   C3T  _C11    57     1.52557   103.36621   155.99618
   46    43 S   CT   _C8_    41     1.52561   113.43245   173.04275
   47    46 S   HC   _H3_    42     1.09862   110.35085   -38.19814
   48    45 S   C3T  _C12    58     1.50732   108.08895   -23.27764
   49    48 S   HC   _H6_    59     1.07904   121.55233   147.99115
   50    46 S   CM   _C17    43     1.49460    99.93579  -150.88487
   51    46 S   CT   _C7_    50     1.52463   113.67386    85.55318
   52    51 S   HC   _H13    51     1.09780   108.88796   171.74388
   53    51 S   HC   _H14    52     1.09674   110.84760    55.86058
   54    33 S   CT   _C13    60     1.59795   115.05074   -61.33788
   55    54 S   OM   _O34    61     1.32349   113.73919   -32.44669
   56    54 S   HC   _H7_    62     1.09963   106.62723   100.02176
   57    45 S   O3T  _O33    63     1.44113   111.46680   -85.40791
   58    50 S   CO4  _C16    44     1.47590   108.15584    25.31646
   59    58 S   O    _O36    45     1.21715   127.27202   168.54252
   60    50 S   CM   _C18    47     1.33607   130.64642  -153.25006
   61    60 S   HC   _H18    48     1.08415   121.45575    -1.20496
   62    60 S   HC   _H19    49     1.08550   121.57017   179.16984
   63    51 S   CT   _C6_    53     1.52490   113.85066   -69.23644
   64    63 S   HC   _H11    54     1.09936   106.98569  -170.47818
   65    63 S   HC   _H12    55     1.09884   109.18165   -57.82479
   66    43 S   OS   _O35    46     1.44346   110.21611    56.40847
   67    63 S   CT   _C5_    56     1.53804   117.47120    67.17411
   68    67 S   CT   _C4_    64     1.53102   113.57300    54.34403
   69    68 S   HC   _H8_    65     1.09651   110.53185   171.80238
   70    68 S   HC   _H9_    66     1.09653   110.74506    54.44862
   71    68 S   HC   _H10    67     1.08942   113.86694   -66.99145
   72    67 S   OH   _O37    68     1.44970   104.69152   167.79923
   73    72 S   HO   _H20    69     0.97206   108.39109   -62.03963
  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
  18   2   1   1  24  10   9   3   2   1  17   7  19  15   8   9
   5  10  11   5   4   4   2   1   4   5   2   3   1   1   9   4
   3   1   6   5   3   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    45    48    54    55    56    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    44    46    66    67    45    48    49    54    55    56    57    39    40    41    42  
   35    36  
   36  
    0  
   38    43    44    46    47    50    58    66    51    63    67    45    48    49    54    55    56    57    68    72    39    40    41    42  
   43    44    46    66    67    45    48    54    57    39  
   40    41    42    43    45    48    54    55    56  
   41    42    54  
   42    54  
   54  
   44    46    47    50    58    59    66    60    51    52    53    63    67    45    48    54    57  
   46    47    50    58    66    51    45  
   48    49    54    55    56    57    68    69    70    71    72    73    46    51    63    64    65    66    67  
   47    50    58    59    66    60    61    62    51    52    53    63    64    65    67  
   50    58    66    60    51    52    53    63  
   49    54    55    56    57    68    72    63    67  
   54    55    56    57    67  
   58    59    66    60    61    62    51    52    53    63  
   52    53    63    64    65    67    68    72    58    60    66  
   53    63    64    65    67  
   63    64    65    67  
   55    56    57    67  
   56    57  
   57  
   68    72    63    67  
   59    66    60    61    62  
   66    60  
   61    62    66  
   62  
    0  
   64    65    67    68    69    70    71    72    73  
   65    67    68    72  
   67    68    72  
    0  
   68    69    70    71    72    73  
   69    70    71    72    73  
   70    71    72  
   71    72  
   72  
   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   0.167500   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   56   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   58   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   67   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    54   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    43   268.000  1.529
   37    45   275.000  1.510
   43    44   340.000  1.090
   43    46   268.000  1.529
   43    66   320.000  1.410
   46    47   340.000  1.090
   46    50   317.000  1.510
   46    51   268.000  1.529
   50    58   320.000  1.462
   50    60   549.000  1.340
   58    59   570.000  1.229
   58    66   214.000  1.327
   60    61   340.000  1.080
   60    62   340.000  1.080
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    67   268.000  1.529
   67    45   275.000  1.510
   67    68   268.000  1.529
   67    72   320.000  1.410
   45    48   260.000  1.509
   45    57   335.000  1.432
   48    49   340.000  1.088
   48    54   275.000  1.510
   48    57   335.000  1.432
   54    55   570.000  1.307
   54    56   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   72    73   553.000  0.945
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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    54    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    43    58.35000  112.70000
   33    37    45    70.00000  112.37300
   33    54    48    70.00000  112.37300
   33    54    55    50.00000  109.50000
   33    54    56    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    44    37.50000  110.70000
   37    43    46    58.35000  112.70000
   37    43    66    50.00000  109.50000
   37    45    67    58.35000  112.70000
   37    45    48    60.00000  120.94000
   37    45    57    80.00000  116.47100
   43    37    38    37.50000  110.70000
   43    46    47    37.50000  110.70000
   43    46    50    70.00000  112.02700
   43    46    51    58.35000  112.70000
   43    66    58    83.00000  116.90000
   46    43    44    37.50000  110.70000
   46    50    58    65.00000  116.34900
   46    50    60    70.00000  124.00000
   46    51    52    37.50000  110.70000
   46    51    53    37.50000  110.70000
   46    51    63    58.35000  112.70000
   50    46    47    35.00000  109.50000
   50    58    59    80.00000  123.72100
   50    58    66    90.00000  111.29400
   50    60    61    35.00000  120.00000
   50    60    62    35.00000  120.00000
   66    43    44    35.00000  109.50000
   66    43    46    50.00000  109.50000
   66    58    59    83.00000  123.40000
   60    50    58    65.00000  118.96000
   62    60    61    35.00000  117.00000
   51    46    47    37.50000  110.70000
   51    46    50    70.00000  112.02700
   51    63    64    37.50000  110.70000
   51    63    65    37.50000  110.70000
   51    63    67    58.35000  112.70000
   53    51    52    33.00000  107.80000
   63    51    52    37.50000  110.70000
   63    51    53    37.50000  110.70000
   63    67    45    70.00000  112.37300
   63    67    68    58.35000  112.70000
   63    67    72    50.00000  109.50000
   65    63    64    33.00000  107.80000
   67    63    64    37.50000  110.70000
   67    63    65    37.50000  110.70000
   67    45    48    60.00000  120.94000
   67    45    57    80.00000  116.47100
   67    68    69    37.50000  110.70000
   67    68    70    37.50000  110.70000
   67    68    71    37.50000  110.70000
   67    72    73    55.00000  108.50000
   45    37    38    45.00000  109.38400
   45    37    43    70.00000  112.37300
   45    48    49    37.50000  117.20000
   45    48    54    60.00000  120.94000
   45    48    57    15.00000   60.43100
   45    57    48    15.00000   59.14900
   48    54    55    50.00000  109.50000
   48    54    56    45.00000  109.38400
   54    33    37    58.35000  112.70000
   54    48    49    40.00000  115.04500
   56    54    55    45.00000  125.66300
   57    45    48    15.00000   60.43100
   57    48    49    50.00000  114.27700
   57    48    54    80.00000  116.47100
   68    67    45    70.00000  112.37300
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   72    67    45    50.00000  109.50000
   72    67    68    50.00000  109.50000
   39    33    37    58.35000  112.70000
   39    33    54    58.35000  112.70000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   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    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    37    45   0.44750  1.0 1.0
   29    33    37    45  -0.17800 -1.0 2.0
   29    33    37    45   0.20200  1.0 3.0
   29    33    54    48   0.44750  1.0 1.0
   29    33    54    48  -0.17800 -1.0 2.0
   29    33    54    48   0.20200  1.0 3.0
   29    33    54    55   0.56750  1.0 1.0
   29    33    54    55  -0.07550 -1.0 2.0
   29    33    54    55   0.20000  1.0 3.0
   29    33    54    56   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    46   0.56750  1.0 1.0
   33    37    43    46  -0.07550 -1.0 2.0
   33    37    43    46   0.20000  1.0 3.0
   33    37    43    66   0.62750  1.0 1.0
   33    37    43    66  -0.30950 -1.0 2.0
   33    37    43    66   0.27300  1.0 3.0
   33    37    45    67   0.56750  1.0 1.0
   33    37    45    67  -0.07550 -1.0 2.0
   33    37    45    67   0.20000  1.0 3.0
   33    37   -45    48   0.07850  1.0 1.0
   33    37   -45    48  -0.03950 -1.0 2.0
   33    37   -45    48   0.67350  1.0 3.0
   33    37    45    57   0.02550  1.0 1.0
   33    37    45    57  -0.02600 -1.0 2.0
   33    37    45    57   1.20400  1.0 3.0
   37    33   -54    48   0.47050  1.0 1.0
   37    33   -54    48   0.03900 -1.0 2.0
   37    33   -54    48   0.20100  1.0 3.0
   37    33    54    55   0.62750  1.0 1.0
   37    33    54    55  -0.30950 -1.0 2.0
   37    33    54    55   0.27300  1.0 3.0
   37    33    54    56   0.15000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43    46    47   0.15000  1.0 3.0
   37    43    46    50   0.34400  1.0 1.0
   37    43    46    50   0.09450 -1.0 2.0
   37    43    46    50   0.11100  1.0 3.0
   37    43    46    51   0.56750  1.0 1.0
   37    43    46    51  -0.07550 -1.0 2.0
   37    43    46    51   0.20000  1.0 3.0
   37    43    66    58  -0.25900  1.0 1.0
   37    43    66    58  -0.47000 -1.0 2.0
   37    43    66    58   0.11750  1.0 3.0
   37    45    48    49   0.15000  1.0 3.0
   37    45   -48    54   0.56750  1.0 1.0
   37    45   -48    54  -0.07550 -1.0 2.0
   37    45   -48    54   0.20000  1.0 3.0
   37    45   -48    57   0.02550  1.0 1.0
   37    45   -48    57  -0.02600 -1.0 2.0
   37    45   -48    57   1.20400  1.0 3.0
   37    45   -57    48   0.06250  1.0 1.0
   37    45   -57    48  -0.01100 -1.0 2.0
   37    45   -57    48   0.28050  1.0 3.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    46   0.15000  1.0 3.0
   38    37    43    66   0.23400  1.0 3.0
   38    37    45    67   0.15000  1.0 3.0
   38    37    45    48   0.15000  1.0 3.0
   38    37    45    57   0.23400  1.0 3.0
   43    37    45    67   0.56750  1.0 1.0
   43    37    45    67  -0.07550 -1.0 2.0
   43    37    45    67   0.20000  1.0 3.0
   43    37    45    48   0.07850  1.0 1.0
   43    37    45    48  -0.03950 -1.0 2.0
   43    37    45    48   0.67350  1.0 3.0
   43    37    45    57   0.02550  1.0 1.0
   43    37    45    57  -0.02600 -1.0 2.0
   43    37    45    57   1.20400  1.0 3.0
   43    46   -50    58   0.09700  1.0 1.0
   43    46   -50    58   0.15600 -1.0 2.0
   43    46   -50    58  -0.50800  1.0 3.0
   43    46    50    60   0.09850  1.0 1.0
   43    46    50    60   0.15250 -1.0 2.0
   43    46    50    60  -0.50650  1.0 3.0
   43    46    51    52   0.15000  1.0 3.0
   43    46    51    53   0.15000  1.0 3.0
   43    46    51    63   0.56750  1.0 1.0
   43    46    51    63  -0.07550 -1.0 2.0
   43    46    51    63   0.20000  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    50   0.15000  1.0 3.0
   44    43    46    51   0.15000  1.0 3.0
   44    43    66    58   0.08050  1.0 3.0
   46    43   -66    58  -0.25900  1.0 1.0
   46    43   -66    58  -0.47000 -1.0 2.0
   46    43   -66    58   0.11750  1.0 3.0
   46    50    58    59  -0.64400  1.0 1.0
   46    50    58    59   0.26850 -1.0 2.0
   46    50   -58    66  -0.15000  1.0 1.0
   46    50   -58    66   0.89550 -1.0 2.0
   46    50   -58    66  -0.06900  1.0 3.0
   46    50    60    61   7.00000 -1.0 2.0
   46    50    60    62   7.00000 -1.0 2.0
   46    51    63    64   0.15000  1.0 3.0
   46    51    63    65   0.15000  1.0 3.0
   46    51    63    67   0.56750  1.0 1.0
   46    51    63    67  -0.07550 -1.0 2.0
   46    51    63    67   0.20000  1.0 3.0
   47    46    50    58   0.15000  1.0 3.0
   47    46    50    60   0.00000  1.0 1.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    53   0.15000  1.0 3.0
   47    46    51    63   0.15000  1.0 3.0
   50    46    51    52   0.15000  1.0 3.0
   50    46    51    53   0.15000  1.0 3.0
   50    46    51    63   0.34400  1.0 1.0
   50    46    51    63   0.09450 -1.0 2.0
   50    46    51    63   0.11100  1.0 3.0
   50    58   -66    43   2.00000 -1.0 2.0
   58    50    60    61   7.00000 -1.0 2.0
   58    50    60    62   7.00000 -1.0 2.0
   59    58    66    43   3.00000 -1.0 2.0
   66    43    46    47   0.23400  1.0 3.0
   66    43   -46    50   0.61850  1.0 1.0
   66    43   -46    50  -0.22750 -1.0 2.0
   66    43   -46    50   0.15300  1.0 3.0
   66    43    46    51   0.62750  1.0 1.0
   66    43    46    51  -0.30950 -1.0 2.0
   66    43    46    51   0.27300  1.0 3.0
   60    50    58    59   1.00000 -1.0 2.0
   60    50    58    66  -0.56150  1.0 1.0
   60    50    58    66   2.19150 -1.0 2.0
   51    46    50    58   0.09700  1.0 1.0
   51    46    50    58   0.15600 -1.0 2.0
   51    46    50    58  -0.50800  1.0 3.0
   51    46    50    60   0.09850  1.0 1.0
   51    46    50    60   0.15250 -1.0 2.0
   51    46    50    60  -0.50650  1.0 3.0
   51    63    67    45   0.47050  1.0 1.0
   51    63    67    45   0.03900 -1.0 2.0
   51    63    67    45   0.20100  1.0 3.0
   51    63    67    68   0.56750  1.0 1.0
   51    63    67    68  -0.07550 -1.0 2.0
   51    63    67    68   0.20000  1.0 3.0
   51    63    67    72   0.86500  1.0 1.0
   51    63    67    72  -0.17500 -1.0 2.0
   51    63    67    72   0.20800  1.0 3.0
   52    51    63    64   0.15000  1.0 3.0
   52    51    63    65   0.15000  1.0 3.0
   52    51    63    67   0.15000  1.0 3.0
   53    51    63    64   0.15000  1.0 3.0
   53    51    63    65   0.15000  1.0 3.0
   53    51    63    67   0.15000  1.0 3.0
   63    67    45    37   0.56750  1.0 1.0
   63    67    45    37  -0.07550 -1.0 2.0
   63    67    45    37   0.20000  1.0 3.0
   63    67    45    48   0.07850  1.0 1.0
   63    67    45    48  -0.03950 -1.0 2.0
   63    67    45    48   0.67350  1.0 3.0
   63    67    45    57   0.02550  1.0 1.0
   63    67    45    57  -0.02600 -1.0 2.0
   63    67    45    57   1.20400  1.0 3.0
   63    67    68    69   0.15000  1.0 3.0
   63    67    68    70   0.15000  1.0 3.0
   63    67    68    71   0.15000  1.0 3.0
   63    67    72    73  -0.11600  1.0 1.0
   63    67    72    73  -0.09450 -1.0 2.0
   63    67    72    73   0.21250  1.0 3.0
   64    63    67    45   0.15000  1.0 3.0
   64    63    67    68   0.15000  1.0 3.0
   64    63    67    72   0.23400  1.0 3.0
   65    63    67    45   0.15000  1.0 3.0
   65    63    67    68   0.15000  1.0 3.0
   65    63    67    72   0.23400  1.0 3.0
   67    45    48    49   0.15000  1.0 3.0
   67    45    48    54   0.56750  1.0 1.0
   67    45    48    54  -0.07550 -1.0 2.0
   67    45    48    54   0.20000  1.0 3.0
   67    45   -48    57   0.02550  1.0 1.0
   67    45   -48    57  -0.02600 -1.0 2.0
   67    45   -48    57   1.20400  1.0 3.0
   67    45   -57    48   0.06250  1.0 1.0
   67    45   -57    48  -0.01100 -1.0 2.0
   67    45   -57    48   0.28050  1.0 3.0
   45    37    43    44   0.15000  1.0 3.0
   45    37    43    46   0.47050  1.0 1.0
   45    37    43    46   0.03900 -1.0 2.0
   45    37    43    46   0.20100  1.0 3.0
   45    37    43    66  -0.26800  1.0 1.0
   45    37    43    66   0.69150 -1.0 2.0
   45    37    43    66  -0.48750  1.0 3.0
   45    67    68    69   0.15000  1.0 3.0
   45    67    68    70   0.15000  1.0 3.0
   45    67    68    71   0.15000  1.0 3.0
   45    67    72    73  -0.11600  1.0 1.0
   45    67    72    73  -0.09450 -1.0 2.0
   45    67    72    73   0.21250  1.0 3.0
   45    48   -54    33   0.07850  1.0 1.0
   45    48   -54    33  -0.03950 -1.0 2.0
   45    48   -54    33   0.67350  1.0 3.0
   45    48    54    55  -0.26800  1.0 1.0
   45    48    54    55   0.69150 -1.0 2.0
   45    48    54    55  -0.48750  1.0 3.0
   45    48    54    56   0.15000  1.0 3.0
   49    48    54    33   0.15000  1.0 3.0
   49    48    54    55   0.23400  1.0 3.0
   49    48    54    56   0.15000  1.0 3.0
   49    48   -57    45   0.36800  1.0 3.0
   54    33    37    38   0.15000  1.0 3.0
   54    33    37    43   0.56750  1.0 1.0
   54    33    37    43  -0.07550 -1.0 2.0
   54    33    37    43   0.20000  1.0 3.0
   54    33   -37    45   0.47050  1.0 1.0
   54    33   -37    45   0.03900 -1.0 2.0
   54    33   -37    45   0.20100  1.0 3.0
   54    33    39    40   0.15000  1.0 3.0
   54    33    39    41   0.15000  1.0 3.0
   54    33    39    42   0.15000  1.0 3.0
   54    48   -57    45   0.06250  1.0 1.0
   54    48   -57    45  -0.01100 -1.0 2.0
   54    48   -57    45   0.28050  1.0 3.0
   57    45   -48    49   0.23400  1.0 3.0
   57    45   -48    54   0.02550  1.0 1.0
   57    45   -48    54  -0.02600 -1.0 2.0
   57    45   -48    54   1.20400  1.0 3.0
   57    48   -54    33   0.02550  1.0 1.0
   57    48   -54    33  -0.02600 -1.0 2.0
   57    48   -54    33   1.20400  1.0 3.0
   57    48    54    55   1.11900  1.0 1.0
   57    48    54    55  -1.16350 -1.0 2.0
   57    48    54    55  -0.34150  1.0 3.0
   57    48    54    56   0.23400  1.0 3.0
   68    67    45    37   0.56750  1.0 1.0
   68    67    45    37  -0.07550 -1.0 2.0
   68    67    45    37   0.20000  1.0 3.0
   68    67    45    48   0.07850  1.0 1.0
   68    67    45    48  -0.03950 -1.0 2.0
   68    67    45    48   0.67350  1.0 3.0
   68    67    45    57   0.02550  1.0 1.0
   68    67    45    57  -0.02600 -1.0 2.0
   68    67    45    57   1.20400  1.0 3.0
   68    67    72    73  -0.11600  1.0 1.0
   68    67    72    73  -0.09450 -1.0 2.0
   68    67    72    73   0.21250  1.0 3.0
   72    67    45    37   0.86500  1.0 1.0
   72    67    45    37  -0.17500 -1.0 2.0
   72    67    45    37   0.20800  1.0 3.0
   72    67    45    48   0.86500  1.0 1.0
   72    67    45    48  -0.17500 -1.0 2.0
   72    67    45    48   0.20800  1.0 3.0
   72    67    45    57   3.69350  1.0 1.0
   72    67    45    57  -1.82950 -1.0 2.0
   72    67    68    69   0.23400  1.0 3.0
   72    67    68    70   0.23400  1.0 3.0
   72    67    68    71   0.23400  1.0 3.0
   39    33    37    38   0.15000  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    37    45   0.47050  1.0 1.0
   39    33    37    45   0.03900 -1.0 2.0
   39    33    37    45   0.20100  1.0 3.0
   39    33    54    48   0.47050  1.0 1.0
   39    33    54    48   0.03900 -1.0 2.0
   39    33    54    48   0.20100  1.0 3.0
   39    33    54    55   0.62750  1.0 1.0
   39    33    54    55  -0.30950 -1.0 2.0
   39    33    54    55   0.27300  1.0 3.0
   39    33    54    56   0.15000  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
   46    58    50    60   1.10000 -1.0 2.0
   50    66    58    59  10.50000 -1.0 2.0
   61    62    60    50   1.10000 -1.0 2.0
END
