* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    144    233     424
    1     0 S   NP   _N1_     1    29.04599    93.60734   -23.31472
    2     1 S   H    _HN1     2     1.02953    87.49919    14.02226
    3     1 S   H    _H1_     3     1.02828    23.29671   161.67222
    4     1 S   H    _H2_     4     1.02782   103.45754   -94.24787
    5     1 S   CT   _CA1     5     1.50120   131.21233   129.19691
    6     5 S   HC   _HA1     6     1.09574   105.20680    72.30058
    7     5 S   CO3  _C1_     7     1.53791   112.41668   -47.92575
    8     7 S   O2Z  _O11     8     1.26372   115.00739   -43.14297
    9     7 S   O2Z  _O12     9     1.26239   114.94324   135.96690
   10     5 S   CT   _CB1    10     1.53076   107.41145  -169.74395
   11    10 S   HC   HB11    11     1.09830   109.36344   -49.97541
   12    10 S   HC   HB12    12     1.09817   110.43953    66.61467
   13    10 S   CT   _CG1    13     1.52993   112.62854  -170.98916
   14    13 S   HC   HG11    14     1.09587   110.56345   -64.96093
   15    13 S   HC   HG12    15     1.09666   109.86978    54.28649
   16    13 S   C    _CD1    16     1.51794   112.24586   174.68581
   17    16 S   O    _OE1    17     1.22729   123.27427     3.77958
   18    16 S   N    _N2_    18     1.38642   111.66325  -176.31969
   19    18 S   H    _HN2    19     1.01586   119.00819     1.12726
   20    18 S   CT1  _CA2    20     1.46099   123.31891   178.23398
   21    20 S   HC   _HA2    21     1.09577   109.28579    -3.62304
   22    20 S   C    _C2_    22     1.53478   108.70902  -118.66164
   23    22 S   O    _O2_    23     1.23051   122.25965  -149.28508
   24    20 S   CT   _CB2    32     1.53312   111.70565   118.85018
   25    24 S   HC   HB21    33     1.09652   109.66013    60.94919
   26    24 S   HC   HB22    34     1.09565   111.01450   178.42368
   27    22 S   N    _N3_    24     1.38336   113.62963    38.26747
   28    27 S   H    _HN3    25     1.01618   119.50800    -3.59461
   29    24 S   S    _SG2    35     1.82855   114.33434   -58.83600
   30    27 S   CT   _CA3    26     1.45280   123.17471   176.93612
   31    30 S   HC   HA31    27     1.09551   107.52332   -63.95606
   32    30 S   HC   HA32    28     1.09558   107.95711    52.45963
   33    29 S   CT   _C18    36     1.82411    99.73723   -68.88148
   34    33 S   HC   _H21    37     1.09116   108.36435    63.01132
   35    33 S   HC   _H22    38     1.09441   108.91979   -55.64167
   36    30 S   CO3  _C3_    29     1.52945   114.11610   174.44483
   37    36 S   O2Z  _O31    30     1.26369   116.06871    -0.85775
   38    36 S   O2Z  _O32    31     1.26430   114.40878   179.20500
   39    33 S   CT   _C17    39     1.53177   109.67164  -176.43773
   40    39 S   HC   _H19    40     1.09780   109.57931   -64.11469
   41    39 S   HC   _H20    41     1.09660   108.01133    52.30549
   42    39 S   CT   _C6_    42     1.54090   113.35821   172.83905
   43    42 S   HC   _H3_    43     1.09662   109.93897   -53.19281
   44    42 S   C    _C7_    44     1.52993   109.93398    66.26454
   45    44 S   O    _O33    45     1.22106   126.11349   -68.43007
   46    44 S   N    _N4_    46     1.38491   107.80493   111.06005
   47    46 S   H    _H9_    47     1.01417   120.20326  -179.70459
   48    46 S   C4T  _C8_    48     1.47585   114.66400     6.18637
   49    48 S   CO4  _C9_    49     1.55774   113.23733    88.99744
   50    49 S   O    _O34    50     1.20943   138.79470    83.14675
   51    42 S   C4T  _C5_    52     1.55608   112.32504  -175.58589
   52    48 S   CT   _C10    57     1.52696   113.73698  -131.09356
   53    52 S   HC   _H4_    58     1.09764   109.63032  -175.71143
   54    49 S   O4T  _O35    51     1.36179    93.55949   -93.76007
   55    51 S   CT   _C4_    53     1.51900   118.03103    30.56482
   56    55 S   HC   _H6_    54     1.09578   111.19090   175.95727
   57    55 S   HC   _H7_    55     1.09525   110.86503    56.75390
   58    55 S   HC   _H8_    56     1.09388   112.03745   -64.27362
   59    52 S   CT   _C11    59     1.55456   114.72556   -51.46693
   60    59 S   HC   _H5_    60     1.09889   108.40255    65.58246
   61    52 S   OH   _O36    74     1.43429   106.49907    68.38247
   62    61 S   HO   _H18    75     0.97217   107.81961   153.34544
   63    59 S   CM   _C16    61     1.52011   111.05322  -179.19789
   64    63 S   HC   _H17    62     1.08651   118.20849   -43.62820
   65    63 S   CM   _C15    63     1.34077   124.14732   137.91590
   66    65 S   HC   _H16    64     1.08651   119.23880  -179.28838
   67    65 S   CT   _C14    65     1.49653   123.36647     2.01032
   68    67 S   HC   _H14    66     1.09583   109.51366   135.81798
   69    67 S   HC   _H15    67     1.09634   108.61268  -107.49449
   70    67 S   CT   _C13    68     1.52679   112.37262    14.47779
   71    70 S   HC   _H12    69     1.09758   109.78615    76.65914
   72    70 S   HC   _H13    70     1.09593   109.61057  -166.25075
   73    59 S   CT   _C12    71     1.54180   112.56886   -54.39368
   74    73 S   HC   _H10    72     1.09522   109.95072    72.00628
   75    73 S   HC   _H11    73     1.09735   110.03682   -46.31460
  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   7   5   4   3
   9   5   4   2   1   1  11   5   4  14   7   9   4  11   4  16
   8   3   9  14   6   4   3   2   1   1  14   8   3   1  10   4
   8   4   8   5   4   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    51  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48    54    51    55  
   41    42    43    44    51  
   42    43    44    51  
   43    44    45    46    47    48    49    54    51    55    56    57    58    52  
   44    45    46    48    54    51    55  
   45    46    47    48    49    54    51    55    52  
   46    47    48    51  
   47    48    49    50    54    51    55    52    53    59    61  
   48    49    51    52  
   49    50    54    51    55    56    57    58    52    53    59    60    63    73    61    62  
   50    54    51    55    52    53    59    61  
   54    51    52  
   55    56    57    58    52    53    59    61    54  
   53    59    60    63    64    65    70    73    74    75    61    62    54    55  
   59    60    63    73    61    62  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    0  
   60    63    64    65    66    67    70    71    72    73    74    75    61    62  
   63    64    65    70    73    74    75    61  
   62    63    73  
    0  
   64    65    66    67    68    69    70    73    74    75  
   65    66    67    73  
   66    67    68    69    70    71    72    73  
   67    68    69    70  
   68    69    70    71    72    73    74    75  
   69    70    71    72    73  
   70    71    72    73  
   71    72    73    74    75  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.001200   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.2500   0.1700  -0.422500   1.8100   1.6000   0.054801302  -1.445846770
   47   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   48   3.5000   0.0660   0.164100   1.9750   1.7500   0.005000000  -0.741685710
   49   3.7500   0.1050   0.449400   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5000   0.0660   0.100800   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.9000   0.1400  -0.338200   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0660  -0.121200   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   268.000  1.529
   42    43   340.000  1.090
   42    44   317.000  1.522
   42    51   260.000  1.519
   44    45   570.000  1.229
   44    46   490.000  1.335
   46    47   434.000  1.010
   46    48   337.000  1.449
   48    49   255.000  1.551
   48    51   268.000  1.529
   48    52   260.000  1.519
   49    50   570.000  1.229
   49    54   460.000  1.355
   54    51   320.000  1.440
   51    55   260.000  1.519
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   52    53   340.000  1.090
   52    59   268.000  1.529
   52    61   320.000  1.410
   59    60   340.000  1.090
   59    63   317.000  1.510
   59    73   268.000  1.529
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   340.000  1.080
   65    67   317.000  1.510
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   61    62   553.000  0.945
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    37.50000  110.70000
   39    42    44    63.00000  111.10000
   39    42    51    70.00000  112.98000
   41    39    40    33.00000  107.80000
   42    39    40    37.50000  110.70000
   42    39    41    37.50000  110.70000
   42    44    45    80.00000  120.40000
   42    44    46    70.00000  116.60000
   42    51    48    65.00000  119.52000
   42    51    54    50.00000  109.50000
   42    51    55    58.35000  112.70000
   44    42    43    35.00000  109.50000
   44    46    47    35.00000  119.80000
   44    46    48    50.00000  121.90000
   46    44    45    80.00000  122.90000
   46    48    49    80.00000  109.34500
   46    48    51    80.00000  110.05700
   46    48    52    80.00000  110.05700
   48    46    47    38.00000  118.40000
   48    49    50    65.00000  127.62700
   48    49    54   110.00000   93.13000
   48    51    54   110.00000   93.94000
   48    51    55    65.00000  119.52000
   48    52    53    45.00000  111.22300
   48    52    59    70.00000  112.98000
   48    52    61    50.00000  109.50000
   49    54    51   125.00000   91.21600
   54    49    50   100.00000  124.42500
   54    51    55    50.00000  109.50000
   51    42    43    45.00000  111.22300
   51    42    44    63.00000  111.10000
   51    48    49    90.00000   90.40100
   51    55    56    45.00000  111.22300
   51    55    57    45.00000  111.22300
   51    55    58    45.00000  111.22300
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   52    48    49    63.00000  111.10000
   52    48    51    65.00000  119.52000
   52    59    60    37.50000  110.70000
   52    59    63    70.00000  112.02700
   52    59    73    58.35000  112.70000
   52    61    62    55.00000  108.50000
   59    52    53    37.50000  110.70000
   59    63    64    35.00000  117.00000
   59    63    65    70.00000  124.00000
   59    73    70    58.35000  112.70000
   59    73    74    37.50000  110.70000
   59    73    75    37.50000  110.70000
   63    59    60    35.00000  109.50000
   63    65    66    35.00000  120.00000
   63    65    67    70.00000  124.00000
   65    63    64    35.00000  120.00000
   65    67    68    35.00000  109.50000
   65    67    69    35.00000  109.50000
   65    67    70    70.00000  112.02700
   67    65    66    35.00000  117.00000
   67    70    71    37.50000  110.70000
   67    70    72    37.50000  110.70000
   67    70    73    58.35000  112.70000
   69    67    68    33.00000  107.80000
   70    67    68    37.50000  110.70000
   70    67    69    37.50000  110.70000
   70    73    74    37.50000  110.70000
   70    73    75    37.50000  110.70000
   72    70    71    33.00000  107.80000
   73    59    60    37.50000  110.70000
   73    59    63    70.00000  112.02700
   73    70    71    37.50000  110.70000
   73    70    72    37.50000  110.70000
   75    73    74    33.00000  107.80000
   61    52    53    35.00000  109.50000
   61    52    59    50.00000  109.50000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   33    39    42    43   0.15000  1.0 3.0
   33    39    42    44  -0.95700  1.0 1.0
   33    39    42    44  -0.18200 -1.0 2.0
   33    39    42    44   0.29450  1.0 3.0
   33    39    42    51   0.31550 -1.0 2.0
   33    39    42    51   0.11250  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    42   0.15000  1.0 3.0
   39    42    44    45   0.30150 -1.0 2.0
   39    42    44    46   1.39750  1.0 1.0
   39    42    44    46  -0.07950 -1.0 2.0
   39    42    44    46  -0.18750  1.0 3.0
   39    42    51    48   0.04050  1.0 1.0
   39    42    51    48   0.63700 -1.0 2.0
   39    42    51    48   0.17650  1.0 3.0
   39    42    51    54   0.62750  1.0 1.0
   39    42    51    54  -0.30950 -1.0 2.0
   39    42    51    54   0.27300  1.0 3.0
   39    42    51    55   0.56750  1.0 1.0
   39    42    51    55  -0.07550 -1.0 2.0
   39    42    51    55   0.20000  1.0 3.0
   40    39    42    43   0.15000  1.0 3.0
   40    39    42    44  -0.11250  1.0 3.0
   40    39    42    51   0.15000  1.0 3.0
   41    39    42    43   0.15000  1.0 3.0
   41    39    42    44  -0.11250  1.0 3.0
   41    39    42    51   0.15000  1.0 3.0
   42    44    46    47   2.45000 -1.0 2.0
   42    44   -46    48   1.49850  1.0 1.0
   42    44   -46    48   1.53950 -1.0 2.0
   42    51    55    56   0.15000  1.0 3.0
   42    51    55    57   0.15000  1.0 3.0
   42    51    55    58   0.15000  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.00000  1.0 1.0
   43    42    51    48   0.00000  1.0 1.0
   43    42    51    54   0.23400  1.0 3.0
   43    42    51    55   0.15000  1.0 3.0
   44    42   -51    48  -0.95700  1.0 1.0
   44    42   -51    48  -0.18200 -1.0 2.0
   44    42   -51    48   0.29450  1.0 3.0
   44    42    51    54  -0.09450  1.0 1.0
   44    42    51    54  -1.12950 -1.0 2.0
   44    42    51    54   0.54000  1.0 3.0
   44    42    51    55  -0.95700  1.0 1.0
   44    42    51    55  -0.18200 -1.0 2.0
   44    42    51    55   0.29450  1.0 3.0
   44    46    48    49  -0.42300  1.0 1.0
   44    46    48    49  -0.07000 -1.0 2.0
   44    46    48    49   0.04150  1.0 3.0
   44    46   -48    51  -0.43950  1.0 1.0
   44    46   -48    51  -0.08100 -1.0 2.0
   44    46   -48    51   0.03350  1.0 3.0
   44    46    48    52  -0.43950  1.0 1.0
   44    46    48    52  -0.08100 -1.0 2.0
   44    46    48    52   0.03350  1.0 3.0
   45    44    46    47   2.45000 -1.0 2.0
   45    44    46    48   3.04450 -1.0 2.0
   46    48    49    50   0.30150 -1.0 2.0
   46    48    49    54   0.40000  1.0 3.0
   46    48   -51    42   0.43900  1.0 1.0
   46    48   -51    42   0.49100 -1.0 2.0
   46    48   -51    42   0.28400  1.0 3.0
   46    48   -51    54   1.12100  1.0 1.0
   46    48   -51    54  -0.16500 -1.0 2.0
   46    48    51    55   0.43900  1.0 1.0
   46    48    51    55   0.49100 -1.0 2.0
   46    48    51    55   0.28400  1.0 3.0
   46    48    52    53   0.15000  1.0 3.0
   46    48    52    59   0.43900  1.0 1.0
   46    48    52    59   0.49100 -1.0 2.0
   46    48    52    59   0.28400  1.0 3.0
   46    48    52    61   2.76900  1.0 1.0
   46    48    52    61  -0.24350 -1.0 2.0
   46    48    52    61  -0.78250  1.0 3.0
   47    46    48    49   0.00000  1.0 1.0
   47    46    48    51   0.00000  1.0 1.0
   47    46    48    52   0.00000  1.0 1.0
   48    49   -54    51   0.00000  1.0 1.0
   48    51    55    56   0.00000  1.0 1.0
   48    51    55    57   0.00000  1.0 1.0
   48    51    55    58   0.00000  1.0 1.0
   48    52    59    60   0.15000  1.0 3.0
   48    52    59    63   0.34400  1.0 1.0
   48    52    59    63   0.09450 -1.0 2.0
   48    52    59    63   0.11100  1.0 3.0
   48    52    59    73   0.31550 -1.0 2.0
   48    52    59    73   0.11250  1.0 3.0
   48    52    61    62  -0.11600  1.0 1.0
   48    52    61    62  -0.09450 -1.0 2.0
   48    52    61    62   0.21250  1.0 3.0
   49    48    51    42  -0.95700  1.0 1.0
   49    48    51    42  -0.18200 -1.0 2.0
   49    48    51    42   0.29450  1.0 3.0
   49    48   -51    54   0.00000  1.0 1.0
   49    48    51    55  -0.95700  1.0 1.0
   49    48    51    55  -0.18200 -1.0 2.0
   49    48    51    55   0.29450  1.0 3.0
   49    48    52    53  -0.11250  1.0 3.0
   49    48    52    59  -0.95700  1.0 1.0
   49    48    52    59  -0.18200 -1.0 2.0
   49    48    52    59   0.29450  1.0 3.0
   49    48    52    61  -0.09450  1.0 1.0
   49    48    52    61  -1.12950 -1.0 2.0
   49    48    52    61   0.54000  1.0 3.0
   49    54   -51    42  -0.25900  1.0 1.0
   49    54   -51    42  -0.47000 -1.0 2.0
   49    54   -51    42   0.11750  1.0 3.0
   49    54   -51    48   0.00000  1.0 1.0
   49    54   -51    55  -0.25900  1.0 1.0
   49    54   -51    55  -0.47000 -1.0 2.0
   49    54   -51    55   0.11750  1.0 3.0
   50    49    54    51   3.00000 -1.0 2.0
   54    51    55    56   0.23400  1.0 3.0
   54    51    55    57   0.23400  1.0 3.0
   54    51    55    58   0.23400  1.0 3.0
   51    42    44    45   0.30150 -1.0 2.0
   51    42   -44    46   1.39750  1.0 1.0
   51    42   -44    46  -0.07950 -1.0 2.0
   51    42   -44    46  -0.18750  1.0 3.0
   51    48   -49    50  -0.11250  1.0 1.0
   51    48   -49    50   0.11400 -1.0 2.0
   51    48   -49    50  -0.28950  1.0 3.0
   51    48   -49    54   0.00000  1.0 1.0
   51    48    52    53   0.00000  1.0 1.0
   51    48    52    59   0.04050  1.0 1.0
   51    48    52    59   0.63700 -1.0 2.0
   51    48    52    59   0.17650  1.0 3.0
   51    48    52    61   0.86500  1.0 1.0
   51    48    52    61  -0.17500 -1.0 2.0
   51    48    52    61   0.20800  1.0 3.0
   52    48    49    50   0.30150 -1.0 2.0
   52    48    49    54   0.36750  1.0 3.0
   52    48    51    42   0.56750  1.0 1.0
   52    48    51    42  -0.07550 -1.0 2.0
   52    48    51    42   0.20000  1.0 3.0
   52    48   -51    54   0.62750  1.0 1.0
   52    48   -51    54  -0.30950 -1.0 2.0
   52    48   -51    54   0.27300  1.0 3.0
   52    48    51    55   0.56750  1.0 1.0
   52    48    51    55  -0.07550 -1.0 2.0
   52    48    51    55   0.20000  1.0 3.0
   52    59    63    64   0.00000  1.0 1.0
   52    59    63    65   0.09850  1.0 1.0
   52    59    63    65   0.15250 -1.0 2.0
   52    59    63    65  -0.50650  1.0 3.0
   52    59    73    70   0.56750  1.0 1.0
   52    59    73    70  -0.07550 -1.0 2.0
   52    59    73    70   0.20000  1.0 3.0
   52    59    73    74   0.15000  1.0 3.0
   52    59    73    75   0.15000  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    63   0.15000  1.0 3.0
   53    52    59    73   0.15000  1.0 3.0
   53    52    61    62   0.19450  1.0 3.0
   59    52    61    62  -0.11600  1.0 1.0
   59    52    61    62  -0.09450 -1.0 2.0
   59    52    61    62   0.21250  1.0 3.0
   59    63    65    66   7.00000 -1.0 2.0
   59    63    65    67   7.00000 -1.0 2.0
   60    59    63    64   0.33100  1.0 3.0
   60    59    63    65   0.00000  1.0 1.0
   60    59    73    70   0.15000  1.0 3.0
   60    59    73    74   0.15000  1.0 3.0
   60    59    73    75   0.15000  1.0 3.0
   63    59    73    70   0.34400  1.0 1.0
   63    59    73    70   0.09450 -1.0 2.0
   63    59    73    70   0.11100  1.0 3.0
   63    59    73    74   0.15000  1.0 3.0
   63    59    73    75   0.15000  1.0 3.0
   63    65    67    68   0.00000  1.0 1.0
   63    65    67    69   0.00000  1.0 1.0
   63    65   -67    70   0.09850  1.0 1.0
   63    65   -67    70   0.15250 -1.0 2.0
   63    65   -67    70  -0.50650  1.0 3.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    67   7.00000 -1.0 2.0
   65    67    70    71   0.15000  1.0 3.0
   65    67    70    72   0.15000  1.0 3.0
   65    67    70    73   0.34400  1.0 1.0
   65    67    70    73   0.09450 -1.0 2.0
   65    67    70    73   0.11100  1.0 3.0
   66    65    67    68   0.33100  1.0 3.0
   66    65    67    69   0.33100  1.0 3.0
   66    65    67    70   0.00000  1.0 1.0
   67    70   -73    59   0.56750  1.0 1.0
   67    70   -73    59  -0.07550 -1.0 2.0
   67    70   -73    59   0.20000  1.0 3.0
   67    70    73    74   0.15000  1.0 3.0
   67    70    73    75   0.15000  1.0 3.0
   68    67    70    71   0.15000  1.0 3.0
   68    67    70    72   0.15000  1.0 3.0
   68    67    70    73   0.15000  1.0 3.0
   69    67    70    71   0.15000  1.0 3.0
   69    67    70    72   0.15000  1.0 3.0
   69    67    70    73   0.15000  1.0 3.0
   71    70    73    59   0.15000  1.0 3.0
   71    70    73    74   0.15000  1.0 3.0
   71    70    73    75   0.15000  1.0 3.0
   72    70    73    59   0.15000  1.0 3.0
   72    70    73    74   0.15000  1.0 3.0
   72    70    73    75   0.15000  1.0 3.0
   73    59    63    64   0.00000  1.0 1.0
   73    59   -63    65   0.09850  1.0 1.0
   73    59   -63    65   0.15250 -1.0 2.0
   73    59   -63    65  -0.50650  1.0 3.0
   61    52    59    60   0.23400  1.0 3.0
   61    52    59    63   1.05650  1.0 1.0
   61    52    59    63   0.15600 -1.0 2.0
   61    52    59    63   0.53150  1.0 3.0
   61    52    59    73   0.86500  1.0 1.0
   61    52    59    73  -0.17500 -1.0 2.0
   61    52    59    73   0.20800  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
   37    30    36    38  10.50000 -1.0 2.0
   42    46    44    45  10.50000 -1.0 2.0
   47    44    46    48   1.00000 -1.0 2.0
   48    54    49    50  10.50000 -1.0 2.0
   59    64    63    65   1.10000 -1.0 2.0
   67    66    65    63   1.10000 -1.0 2.0
END
