* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    141    229     425
    1     0 S   NP   _N1_     1    28.18257    95.06493   -23.88903
    2     1 S   H    _HN1     2     1.02835    25.12015   168.41722
    3     1 S   H    _H1_     3     1.02776   109.89331  -101.70132
    4     1 S   H    _H2_     4     1.02957    83.02330     5.32634
    5     1 S   CT   _CA1     5     1.50133   127.98354   115.79686
    6     5 S   HC   _HA1     6     1.09575   105.20628    80.31834
    7     5 S   CO3  _C1_     7     1.53780   112.36752   -39.85570
    8     7 S   O2Z  _O11     8     1.26366   114.99512   -43.66202
    9     7 S   O2Z  _O12     9     1.26235   114.93179   135.40634
   10     5 S   CT   _CB1    10     1.53091   107.41819  -161.77884
   11    10 S   HC   HB11    11     1.09828   109.31191   -50.47180
   12    10 S   HC   HB12    12     1.09815   110.43522    66.07983
   13    10 S   CT   _CG1    13     1.53022   112.68183  -171.53981
   14    13 S   HC   HG11    14     1.09592   110.50002   -64.83518
   15    13 S   HC   HG12    15     1.09658   109.90387    54.36956
   16    13 S   C    _CD1    16     1.51850   112.30299   174.72482
   17    16 S   O    _OE1    17     1.22754   123.25926     1.08336
   18    16 S   N    _N2_    18     1.38580   111.71824  -178.91321
   19    18 S   H    _HN2    19     1.01552   118.95446     4.56677
   20    18 S   CT1  _CA2    20     1.45741   122.85202   177.53542
   21    20 S   HC   _HA2    21     1.09747   108.69994    23.02679
   22    20 S   C    _C2_    22     1.52981   108.01551   -93.18608
   23    22 S   O    _O2_    23     1.22900   123.33954   -20.83372
   24    20 S   CT   _CB2    32     1.53272   112.09043   146.28460
   25    24 S   HC   HB21    33     1.09601   110.70733    44.79637
   26    24 S   HC   HB22    34     1.09199   110.15061   162.64525
   27    22 S   N    _N3_    24     1.38618   112.06916   161.60152
   28    27 S   H    _HN3    25     1.01750   120.00581    -2.01596
   29    24 S   S    _SG2    35     1.83049   110.75029   -74.69744
   30    27 S   CT   _CA3    26     1.45278   122.92787   178.02910
   31    30 S   HC   HA31    27     1.09561   107.98692   -50.86963
   32    30 S   HC   HA32    28     1.09540   107.52008    65.57629
   33    29 S   CT   _C8_    36     1.92798   102.47004  -132.56784
   34    30 S   CO3  _C3_    29     1.52954   114.07730  -172.96380
   35    34 S   O2Z  _O31    30     1.26348   116.05676    -4.38209
   36    34 S   O2Z  _O32    31     1.26427   114.43398   175.60297
   37    33 S   CT   _C9_    37     1.56414   106.69218  -161.86687
   38    37 S   HC   _H5_    38     1.09523   108.66052  -173.58418
   39    33 S   CT   _C12    58     1.57560   109.27048    76.64102
   40    39 S   HC   _H6_    59     1.09662   108.36859    80.35875
   41    37 S   CO4  _C10    39     1.52350   101.21714    75.59692
   42    41 S   O    _O33    40     1.22070   127.12142  -161.26433
   43    39 S   OH   _O37    60     1.44026   109.67787   -33.57866
   44    43 S   HO   _H20    61     0.97371   107.74149   155.55933
   45    37 S   CT   _C11    70     1.56397   117.60008   -48.11230
   46    45 S   OM   _O35    71     1.32640   107.20666  -152.57393
   47    45 S   HC   _H13    72     1.10148   106.79406    80.95060
   48    45 S   HC   _H14    73     1.09965   106.88893   -26.95353
   49    41 S   OS   _O34    41     1.37172   109.19310    19.87029
   50    33 S   CT   _C7_    42     1.55123   107.46023   -55.76109
   51    50 S   HC   _H4_    43     1.09180   113.32472    44.34442
   52    50 S   CT   _C6_    44     1.53972   120.86545   174.53621
   53    52 S   HC   _H11    45     1.10060   107.54051   160.68607
   54    52 S   HC   _H12    46     1.09298   110.08029    50.93831
   55    52 S   CT   _C5_    47     1.53866   117.99860   -76.45674
   56    55 S   HC   _H3_    48     1.09863   107.50281   155.03600
   57    55 S   CT   _C14    49     1.53449   113.74024    33.83354
   58    57 S   HC   _H7_    50     1.10000   107.03000   -74.55968
   59    55 S   CT   _C4_    66     1.54011   109.01788   -90.08970
   60    59 S   HC   _H8_    67     1.09534   111.26523    64.42365
   61    59 S   HC   _H9_    68     1.09562   110.79936   -55.64526
   62    59 S   HC   _H10    69     1.09386   111.70887  -174.65174
   63    57 S   CM   _C15    51     1.50849   115.04454   169.44924
   64    63 S   HC   _H15    52     1.08189   123.16880    41.77044
   65    63 S   CM   _C16    53     1.33357   114.61701  -144.51927
   66    65 S   HC   _H16    54     1.07505   128.80137  -175.14163
   67    65 S   CO4  _C17    55     1.46912   105.35353     3.83742
   68    67 S   O    _O36    56     1.22283   122.63686  -171.08740
   69    57 S   CT   _C13    57     1.55110   115.81454    48.31059
   70    69 S   CT   _C18    62     1.54007   116.61313    38.61683
   71    70 S   HC   _H17    63     1.08500   114.65274   -65.42401
   72    70 S   HC   _H18    64     1.09715   110.41249   173.87667
   73    70 S   HC   _H19    65     1.09719   111.60731    55.55772
  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
  23   2   1   1  15   9  21   7   9   3   6   1   5   2   1   1
   6   9   4  12   5   4  13   8  16   7   5   2   1   1   7   4
   5   3   6   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    50    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    49    50    51    52    69    39    40    43    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    49    50    51    52    53    54    55    57    67    69    39    40    43    44    70    45    46    47    48  
   35    36  
   36  
    0  
   38    41    42    49    50    51    52    69    39    40    43    45    46    47    48  
   41    42    49    50    39    45    46    47    48  
   40    43    44    70    71    72    73    45    41    49    50    51    52    55    57    58    63    65    67    68    69  
   43    44    70    50    57    67    69  
   42    49    50    51    52    45    46    47    48  
   49    50    45  
   44    70    50    57    67    69  
   69  
   46    47    48    49    50  
   47    48  
   48  
    0  
   50    51    52    53    54    55  
   51    52    53    54    55    56    57    69    59  
   52    53    54    55  
   53    54    55    56    57    58    63    69    59    60    61    62  
   54    55    56    57    59  
   55    56    57    59  
   56    57    58    63    64    65    67    69    70    59    60    61    62  
   57    58    63    69    59    60    61    62  
   58    63    64    65    66    67    68    69    70    71    72    73    59    60    61    62  
   63    64    65    67    69    70    59  
   60    61    62    63    69  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70  
   65    66    67    69  
   66    67    68    69    70  
   67    68    69  
   68    69    70    71    72    73  
   69    70  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   4.2000   0.3000  -0.140000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   47   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   69   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    50   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   317.000  1.522
   37    45   268.000  1.529
   41    42   570.000  1.229
   41    49   214.000  1.327
   49    50   320.000  1.410
   50    51   340.000  1.090
   50    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    59   268.000  1.529
   57    58   340.000  1.090
   57    63   317.000  1.510
   57    69   268.000  1.529
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   340.000  1.080
   65    67   320.000  1.462
   67    68   570.000  1.229
   67    69   317.000  1.522
   69    39   268.000  1.529
   69    70   268.000  1.529
   39    40   340.000  1.090
   39    43   320.000  1.410
   43    44   553.000  0.945
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   45    46   570.000  1.307
   45    47   340.000  1.090
   45    48   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    50    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    37    45    58.35000  112.70000
   33    50    49    50.00000  109.50000
   33    50    51    37.50000  110.70000
   33    50    52    58.35000  112.70000
   33    39    69    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    43    50.00000  109.50000
   37    41    42    80.00000  120.40000
   37    41    49    81.00000  111.40000
   37    45    46    50.00000  109.50000
   37    45    47    37.50000  110.70000
   37    45    48    37.50000  110.70000
   41    37    38    35.00000  109.50000
   41    49    50    83.00000  116.90000
   49    41    42    83.00000  123.40000
   49    50    51    35.00000  109.50000
   49    50    52    50.00000  109.50000
   50    33    37    58.35000  112.70000
   50    52    53    37.50000  110.70000
   50    52    54    37.50000  110.70000
   50    52    55    58.35000  112.70000
   52    50    51    37.50000  110.70000
   52    55    56    37.50000  110.70000
   52    55    57    58.35000  112.70000
   52    55    59    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    57    58    37.50000  110.70000
   55    57    63    70.00000  112.02700
   55    57    69    58.35000  112.70000
   55    59    60    37.50000  110.70000
   55    59    61    37.50000  110.70000
   55    59    62    37.50000  110.70000
   57    55    56    37.50000  110.70000
   57    63    64    35.00000  117.00000
   57    63    65    70.00000  124.00000
   57    69    67    63.00000  111.10000
   57    69    39    58.35000  112.70000
   57    69    70    58.35000  112.70000
   63    57    58    35.00000  109.50000
   63    65    66    35.00000  120.00000
   63    65    67    65.00000  118.96000
   65    63    64    35.00000  120.00000
   65    67    68    80.00000  123.72100
   65    67    69    65.00000  118.62400
   67    65    66    40.00000  117.72500
   67    69    39    63.00000  111.10000
   67    69    70    63.00000  111.10000
   69    57    58    37.50000  110.70000
   69    57    63    70.00000  112.02700
   69    67    68    80.00000  120.40000
   69    39    40    37.50000  110.70000
   69    39    43    50.00000  109.50000
   69    70    71    37.50000  110.70000
   69    70    72    37.50000  110.70000
   69    70    73    37.50000  110.70000
   39    33    37    58.35000  112.70000
   39    33    50    58.35000  112.70000
   39    43    44    55.00000  108.50000
   43    39    40    35.00000  109.50000
   70    69    39    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   59    55    56    37.50000  110.70000
   59    55    57    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   45    37    38    37.50000  110.70000
   45    37    41    63.00000  111.10000
   47    45    46    45.00000  125.66300
   48    45    46    45.00000  125.66300
   48    45    47    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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    41   0.56750  1.0 1.0
   29    33    37    41  -0.07550 -1.0 2.0
   29    33    37    41   0.20000  1.0 3.0
   29    33    37    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    50    49   0.56750  1.0 1.0
   29    33    50    49  -0.07550 -1.0 2.0
   29    33    50    49   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    52   0.44750  1.0 1.0
   29    33    50    52  -0.17800 -1.0 2.0
   29    33    50    52   0.20200  1.0 3.0
   29    33    39    69   0.44750  1.0 1.0
   29    33    39    69  -0.17800 -1.0 2.0
   29    33    39    69   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    37    41    42   0.30150 -1.0 2.0
   33    37   -41    49   0.36750  1.0 3.0
   33    37    45    46   0.62750  1.0 1.0
   33    37    45    46  -0.30950 -1.0 2.0
   33    37    45    46   0.27300  1.0 3.0
   33    37    45    47   0.15000  1.0 3.0
   33    37    45    48   0.15000  1.0 3.0
   33    50    52    53   0.15000  1.0 3.0
   33    50    52    54   0.15000  1.0 3.0
   33    50    52    55   0.56750  1.0 1.0
   33    50    52    55  -0.07550 -1.0 2.0
   33    50    52    55   0.20000  1.0 3.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   37    33   -50    49   0.62750  1.0 1.0
   37    33   -50    49  -0.30950 -1.0 2.0
   37    33   -50    49   0.27300  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    52   0.56750  1.0 1.0
   37    33    50    52  -0.07550 -1.0 2.0
   37    33    50    52   0.20000  1.0 3.0
   37    33    39    69   0.56750  1.0 1.0
   37    33    39    69  -0.07550 -1.0 2.0
   37    33    39    69   0.20000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   0.86500  1.0 1.0
   37    33    39    43  -0.17500 -1.0 2.0
   37    33    39    43   0.20800  1.0 3.0
   37    41   -49    50   1.63150  1.0 1.0
   37    41   -49    50   2.92000 -1.0 2.0
   38    37    41    42   0.00000  1.0 1.0
   38    37    41    49   0.00000  1.0 1.0
   38    37    45    46   0.23400  1.0 3.0
   38    37    45    47   0.15000  1.0 3.0
   38    37    45    48   0.15000  1.0 3.0
   41    37    45    46  -0.09450  1.0 1.0
   41    37    45    46  -1.12950 -1.0 2.0
   41    37    45    46   0.54000  1.0 3.0
   41    37    45    47  -0.11250  1.0 3.0
   41    37    45    48  -0.11250  1.0 3.0
   41    49   -50    33  -0.25900  1.0 1.0
   41    49   -50    33  -0.47000 -1.0 2.0
   41    49   -50    33   0.11750  1.0 3.0
   41    49    50    51   0.08050  1.0 3.0
   41    49    50    52  -0.25900  1.0 1.0
   41    49    50    52  -0.47000 -1.0 2.0
   41    49    50    52   0.11750  1.0 3.0
   42    41    49    50   3.00000 -1.0 2.0
   49    50    52    53   0.23400  1.0 3.0
   49    50    52    54   0.23400  1.0 3.0
   49    50    52    55   0.62750  1.0 1.0
   49    50    52    55  -0.30950 -1.0 2.0
   49    50    52    55   0.27300  1.0 3.0
   50    33    37    38   0.15000  1.0 3.0
   50    33   -37    41  -0.95700  1.0 1.0
   50    33   -37    41  -0.18200 -1.0 2.0
   50    33   -37    41   0.29450  1.0 3.0
   50    33    37    45   0.56750  1.0 1.0
   50    33    37    45  -0.07550 -1.0 2.0
   50    33    37    45   0.20000  1.0 3.0
   50    33    39    69   0.56750  1.0 1.0
   50    33    39    69  -0.07550 -1.0 2.0
   50    33    39    69   0.20000  1.0 3.0
   50    33    39    40   0.15000  1.0 3.0
   50    33    39    43   0.86500  1.0 1.0
   50    33    39    43  -0.17500 -1.0 2.0
   50    33    39    43   0.20800  1.0 3.0
   50    52    55    56   0.15000  1.0 3.0
   50    52    55    57   0.56750  1.0 1.0
   50    52    55    57  -0.07550 -1.0 2.0
   50    52    55    57   0.20000  1.0 3.0
   50    52    55    59   0.56750  1.0 1.0
   50    52    55    59  -0.07550 -1.0 2.0
   50    52    55    59   0.20000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    52    55   0.15000  1.0 3.0
   52    55    57    58   0.15000  1.0 3.0
   52    55    57    63   0.34400  1.0 1.0
   52    55    57    63   0.09450 -1.0 2.0
   52    55    57    63   0.11100  1.0 3.0
   52    55    57    69   0.56750  1.0 1.0
   52    55    57    69  -0.07550 -1.0 2.0
   52    55    57    69   0.20000  1.0 3.0
   52    55    59    60   0.15000  1.0 3.0
   52    55    59    61   0.15000  1.0 3.0
   52    55    59    62   0.15000  1.0 3.0
   53    52    55    56   0.15000  1.0 3.0
   53    52    55    57   0.15000  1.0 3.0
   53    52    55    59   0.15000  1.0 3.0
   54    52    55    56   0.15000  1.0 3.0
   54    52    55    57   0.15000  1.0 3.0
   54    52    55    59   0.15000  1.0 3.0
   55    57    63    64   0.00000  1.0 1.0
   55    57    63    65   0.09850  1.0 1.0
   55    57    63    65   0.15250 -1.0 2.0
   55    57    63    65  -0.50650  1.0 3.0
   55    57    69    67  -0.95700  1.0 1.0
   55    57    69    67  -0.18200 -1.0 2.0
   55    57    69    67   0.29450  1.0 3.0
   55    57    69    39   0.56750  1.0 1.0
   55    57    69    39  -0.07550 -1.0 2.0
   55    57    69    39   0.20000  1.0 3.0
   55    57    69    70   0.56750  1.0 1.0
   55    57    69    70  -0.07550 -1.0 2.0
   55    57    69    70   0.20000  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55    57    63   0.15000  1.0 3.0
   56    55    57    69   0.15000  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    61   0.15000  1.0 3.0
   56    55    59    62   0.15000  1.0 3.0
   57    55    59    60   0.15000  1.0 3.0
   57    55    59    61   0.15000  1.0 3.0
   57    55    59    62   0.15000  1.0 3.0
   57    63    65    66   7.00000 -1.0 2.0
   57    63   -65    67   7.00000 -1.0 2.0
   57    69    39    33   0.56750  1.0 1.0
   57    69    39    33  -0.07550 -1.0 2.0
   57    69    39    33   0.20000  1.0 3.0
   57    69    39    40   0.15000  1.0 3.0
   57    69    39    43   0.86500  1.0 1.0
   57    69    39    43  -0.17500 -1.0 2.0
   57    69    39    43   0.20800  1.0 3.0
   57    69    70    71   0.15000  1.0 3.0
   57    69    70    72   0.15000  1.0 3.0
   57    69    70    73   0.15000  1.0 3.0
   58    57    63    64   0.33100  1.0 3.0
   58    57    63    65   0.00000  1.0 1.0
   58    57    69    67  -0.11250  1.0 3.0
   58    57    69    39   0.15000  1.0 3.0
   58    57    69    70   0.15000  1.0 3.0
   63    57   -69    67  -0.98800  1.0 1.0
   63    57   -69    67   0.48800 -1.0 2.0
   63    57   -69    67   0.76800  1.0 3.0
   63    57    69    39   0.34400  1.0 1.0
   63    57    69    39   0.09450 -1.0 2.0
   63    57    69    39   0.11100  1.0 3.0
   63    57    69    70   0.34400  1.0 1.0
   63    57    69    70   0.09450 -1.0 2.0
   63    57    69    70   0.11100  1.0 3.0
   63    65    67    68   1.00000 -1.0 2.0
   63    65   -67    69  -0.33500  1.0 1.0
   63    65   -67    69   1.06600 -1.0 2.0
   63    65   -67    69  -0.14000  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   -69    57   0.65300  1.0 1.0
   65    67   -69    57  -0.03850 -1.0 2.0
   65    67   -69    57   0.33900  1.0 3.0
   65    67    69    39   0.65300  1.0 1.0
   65    67    69    39  -0.03850 -1.0 2.0
   65    67    69    39   0.33900  1.0 3.0
   65    67    69    70   0.65300  1.0 1.0
   65    67    69    70  -0.03850 -1.0 2.0
   65    67    69    70   0.33900  1.0 3.0
   66    65    67    68   0.00000  1.0 1.0
   66    65    67    69   0.04550  1.0 1.0
   66    65    67    69   0.83000 -1.0 2.0
   66    65    67    69  -0.04000  1.0 3.0
   67    69    39    33  -0.95700  1.0 1.0
   67    69    39    33  -0.18200 -1.0 2.0
   67    69    39    33   0.29450  1.0 3.0
   67    69    39    40  -0.11250  1.0 3.0
   67    69    39    43  -0.09450  1.0 1.0
   67    69    39    43  -1.12950 -1.0 2.0
   67    69    39    43   0.54000  1.0 3.0
   67    69    70    71  -0.11250  1.0 3.0
   67    69    70    72  -0.11250  1.0 3.0
   67    69    70    73  -0.11250  1.0 3.0
   68    67    69    57   0.30150 -1.0 2.0
   68    67    69    39   0.30150 -1.0 2.0
   68    67    69    70   0.30150 -1.0 2.0
   69    57    63    64   0.00000  1.0 1.0
   69    57   -63    65   0.09850  1.0 1.0
   69    57   -63    65   0.15250 -1.0 2.0
   69    57   -63    65  -0.50650  1.0 3.0
   69    39    43    44  -0.11600  1.0 1.0
   69    39    43    44  -0.09450 -1.0 2.0
   69    39    43    44   0.21250  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41  -0.95700  1.0 1.0
   39    33    37    41  -0.18200 -1.0 2.0
   39    33    37    41   0.29450  1.0 3.0
   39    33    37    45   0.56750  1.0 1.0
   39    33    37    45  -0.07550 -1.0 2.0
   39    33    37    45   0.20000  1.0 3.0
   39    33    50    49   0.62750  1.0 1.0
   39    33    50    49  -0.30950 -1.0 2.0
   39    33    50    49   0.27300  1.0 3.0
   39    33    50    51   0.15000  1.0 3.0
   39    33    50    52   0.56750  1.0 1.0
   39    33    50    52  -0.07550 -1.0 2.0
   39    33    50    52   0.20000  1.0 3.0
   39    69    70    71   0.15000  1.0 3.0
   39    69    70    72   0.15000  1.0 3.0
   39    69    70    73   0.15000  1.0 3.0
   40    39    43    44   0.19450  1.0 3.0
   70    69    39    33   0.56750  1.0 1.0
   70    69    39    33  -0.07550 -1.0 2.0
   70    69    39    33   0.20000  1.0 3.0
   70    69    39    40   0.15000  1.0 3.0
   70    69    39    43   0.86500  1.0 1.0
   70    69    39    43  -0.17500 -1.0 2.0
   70    69    39    43   0.20800  1.0 3.0
   59    55    57    58   0.15000  1.0 3.0
   59    55    57    63   0.34400  1.0 1.0
   59    55    57    63   0.09450 -1.0 2.0
   59    55    57    63   0.11100  1.0 3.0
   59    55    57    69   0.56750  1.0 1.0
   59    55    57    69  -0.07550 -1.0 2.0
   59    55    57    69   0.20000  1.0 3.0
   45    37    41    42   0.30150 -1.0 2.0
   45    37    41    49   0.36750  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    49    41    42  10.50000 -1.0 2.0
   57    64    63    65   1.10000 -1.0 2.0
   67    66    65    63   1.10000 -1.0 2.0
   65    69    67    68  10.50000 -1.0 2.0
END
