* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    138    212     408
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02044    86.33955   -74.86835
    3     1 S   H    _H1_     3     1.02092    93.96663    33.63218
    4     1 S   H    _H2_     4     1.02139    33.39146   152.26535
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C7_    36     1.84038    98.14944   161.77428
   34    33 S   HC   _H4_    37     1.11827   103.87045    33.23228
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C6_    38     1.53779   109.54589   -79.98152
   39    38 S   HC   _H3_    39     1.09283   109.31189    60.84685
   40    38 S   CT   _C5_    40     1.52390   110.09661   179.62466
   41    40 S   HC   _H11    41     1.10177   110.65850   -63.79692
   42    40 S   HC   _H12    42     1.10106   110.60338  -179.84423
   43    38 S   C    _C14    71     1.50670   114.06417   -57.04246
   44    43 S   O    _O40    72     1.22825   122.13097   -30.00961
   45    40 S   CT   _C4_    43     1.51648   110.90607    58.32009
   46    45 S   HC   _H9_    44     1.09213   109.40608  -160.35399
   47    45 S   HC   _H10    45     1.08944   110.39467    82.28052
   48    43 S   N    _N5_    73     1.37538   113.80882   150.85353
   49    48 S   H    _H19    74     1.01476   118.64326    -0.01978
   50    48 S   H    _H20    75     1.01523   122.68489  -179.97202
   51    45 S   CG   _C8_    46     1.49783   115.05726   -40.86269
   52    51 S   HC   _H13    47     1.10154   118.70313  -164.01293
   53    33 S   N*   _N4_    48     1.51881   118.50674   151.12506
   54    53 S   CO   _C9_    49     1.47116   117.04119   -35.67228
   55    54 S   HC   _H5_    50     1.09637   106.24924    34.49923
   56    54 S   CT   _C10    51     1.52947   108.71079   -85.85076
   57    56 S   HC   _H6_    52     1.09484   114.43387    18.44016
   58    56 S   CT   _C11    53     1.51563   103.24331  -104.88614
   59    58 S   HC   _H7_    54     1.09454   113.78490  -153.75828
   60    56 S   OH   _O39    69     1.42627   109.24539   139.60885
   61    60 S   HO   _H18    70     0.96972   106.47618   -68.02435
   62    58 S   CT   _C12    55     1.52284   101.92734   -33.31686
   63    62 S   HC   _H8_    56     1.09625   109.73279   -79.88836
   64    58 S   OH   _O38    67     1.42182   109.68004    83.98682
   65    64 S   HO   _H17    68     0.97061   106.78717    59.98566
   66    54 S   OS   _O33    57     1.44005   115.86540   153.44445
   67    62 S   CT   _C13    58     1.51804   115.51450   156.05957
   68    67 S   HC   _H14    59     1.09210   110.28985    59.97401
   69    67 S   HC   _H15    60     1.09333   110.31459   -60.87929
   70    67 S   OS   _O34    61     1.41791   108.89731   179.57113
   71    70 S   P2   _P1_    62     1.63442   119.41100  -179.97202
   72    71 S   O2Z  _O37    63     1.51253   108.40856   179.96044
   73    71 S   O2Z  _O35    64     1.51339   109.78766    46.53880
   74    71 S   OS   _O36    65     1.63419    99.54610   -67.24489
   75    74 S   HO   _H16    66     0.98079   118.57760   174.71517
  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   9   5   4   3
  17   7   2   1   1  15   8  11   6   5   6   3   6   4   3   2
   1   1   6   2   8  12   6  11   7  12   7   4   1   9   6   3
   1   4   7   3   2   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    51    53    54    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    45    51    52    53    54    55    56    66    43    44    48  
   38    39    40    51    53    54    43  
   36    37  
   37  
    0  
   39    40    41    42    45    46    47    51    53    54    43    44    48    49    50  
   40    41    42    45    53    43    44    48  
   41    42    45    46    47    51    52    53    43    44    48  
   42    45    46    47    51    43  
   45    46    47    51    43  
   44    48    49    50    45    53  
   48    49    50  
   46    47    51    52    53    54  
   47    51    52    53  
   51    52    53  
   49    50  
   50  
    0  
   52    53    54    55    56    66  
   53    54  
   54    55    56    57    58    62    66    60  
   55    56    57    58    59    62    63    66    67    64    60    61  
   56    57    58    62    66    60  
   57    58    59    62    63    66    67    64    65    60    61  
   58    59    62    66    64    60    61  
   59    62    63    66    67    68    69    70    64    65    60    61  
   62    63    66    67    64    65    60  
   61    62    64    66  
    0  
   63    66    67    68    69    70    71    64    65  
   66    67    68    69    70    64  
   65    66    67  
    0  
   67    68    69    70  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   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   0.514200   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   45   3.5000   0.0660   0.215700   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   49   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   50   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.7500   0.1050  -0.072300   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.273100   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1700  -0.065700   1.9050   1.6860   0.051222218  -2.220205820
   54   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.100000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   67   3.5000   0.0660   0.080000   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   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.7400   0.2000   1.662500   2.1070   1.8700   0.005000000   0.000000000
   72   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   73   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   74   2.8500   0.1400  -0.692500   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.380000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    53   337.000  1.475
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    43   317.000  1.522
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    51   290.000  1.488
   51    52   385.000  1.083
   51    53   590.000  1.308
   53    54   275.000  1.479
   54    55   340.000  1.090
   54    56   250.000  1.527
   54    66   320.000  1.380
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    60   320.000  1.410
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    64   320.000  1.410
   62    63   340.000  1.090
   62    66   320.000  1.410
   62    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   320.000  1.410
   70    71   230.000  1.697
   71    72   525.000  1.480
   71    73   525.000  1.480
   71    74   230.000  1.697
   74    75   553.000  0.945
   64    65   553.000  0.945
   60    61   553.000  0.945
   43    44   570.000  1.229
   43    48   490.000  1.335
   48    49   434.000  1.010
   48    50   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    53    80.00000  108.62000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    43    63.00000  111.10000
   33    53    51    85.00000  113.64000
   33    53    54    65.00000  120.78000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    43    44    80.00000  120.40000
   38    43    48    70.00000  116.60000
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    51    70.00000  109.02000
   42    40    41    33.00000  107.80000
   45    40    41    37.50000  110.70000
   45    40    42    37.50000  110.70000
   45    51    52    35.00000  121.91500
   45    51    53    65.00000  114.34000
   47    45    46    33.00000  107.80000
   51    45    46    45.00000  109.33400
   51    45    47    45.00000  109.33400
   51    53    54    65.00000  122.98000
   53    33    34    35.00000  109.50000
   53    33    38    80.00000  111.20000
   53    51    52    45.00000  115.58000
   53    54    55    55.00000  103.44000
   53    54    56    75.00000  107.44000
   53    54    66   105.00000  106.22000
   54    56    57    45.00000  108.72000
   54    56    58    75.00000  109.43000
   54    56    60    90.00000  111.58700
   54    66    62    60.00000  109.50000
   56    54    55    45.00000  112.01100
   56    58    59    37.50000  110.70000
   56    58    62    58.35000  112.70000
   56    58    64    50.00000  109.50000
   56    60    61    55.00000  108.50000
   58    56    57    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    66    50.00000  109.50000
   58    62    67    58.35000  112.70000
   58    64    65    55.00000  108.50000
   62    58    59    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    70    50.00000  109.50000
   66    54    55    35.00000  109.50000
   66    54    56    90.00000  108.56700
   66    62    63    35.00000  109.50000
   67    62    63    37.50000  110.70000
   67    62    66    50.00000  109.50000
   67    70    71   100.00000  120.50000
   69    67    68    33.00000  107.80000
   70    67    68    35.00000  109.50000
   70    67    69    35.00000  109.50000
   70    71    72   100.00000  108.23000
   70    71    73   100.00000  108.23000
   70    71    74    45.00000  102.60000
   71    74    75    45.00000  108.50000
   73    71    72   140.00000  119.90000
   74    71    72   100.00000  108.23000
   74    71    73   100.00000  108.23000
   64    58    59    35.00000  109.50000
   64    58    62    50.00000  109.50000
   60    56    57    35.00000  109.50000
   60    56    58    50.00000  109.50000
   43    38    39    35.00000  109.50000
   43    38    40    63.00000  111.10000
   43    48    49    35.00000  119.80000
   43    48    50    35.00000  119.80000
   48    43    44    80.00000  122.90000
   50    48    49    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    53    51   0.68100  1.0 1.0
   29    33    53    51   0.03350 -1.0 2.0
   29    33    53    51   0.36200  1.0 3.0
   29    33    53    54   0.68100  1.0 1.0
   29    33    53    54   0.03350 -1.0 2.0
   29    33    53    54   0.36200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42   0.15000  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    43    44   0.30150 -1.0 2.0
   33    38    43    48   1.39750  1.0 1.0
   33    38    43    48  -0.07950 -1.0 2.0
   33    38    43    48  -0.18750  1.0 3.0
   33    53    54    55   0.00000  1.0 1.0
   33    53    54    56   2.08450  1.0 1.0
   33    53    54    56  -0.39300 -1.0 2.0
   33    53    54    56   0.23400  1.0 3.0
   33    53    54    66   0.10350  1.0 1.0
   33    53    54    66  -0.15350 -1.0 2.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    53    51   0.00000  1.0 1.0
   34    33    53    54   0.00000  1.0 1.0
   38    33    53    51   2.08450  1.0 1.0
   38    33    53    51  -0.39300 -1.0 2.0
   38    33    53    51   0.23400  1.0 3.0
   38    33    53    54   0.00000  1.0 1.0
   38    40    45    46   0.15000  1.0 3.0
   38    40    45    47   0.15000  1.0 3.0
   38    40   -45    51   0.34400  1.0 1.0
   38    40   -45    51   0.09450 -1.0 2.0
   38    40   -45    51   0.11100  1.0 3.0
   38    43    48    49   2.45000 -1.0 2.0
   38    43    48    50   2.45000 -1.0 2.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    48   0.00000  1.0 1.0
   40    38    43    44   0.30150 -1.0 2.0
   40    38    43    48   1.39750  1.0 1.0
   40    38    43    48  -0.07950 -1.0 2.0
   40    38    43    48  -0.18750  1.0 3.0
   40    45    51    52   0.00000  1.0 1.0
   40    45    51    53  -0.93550  1.0 1.0
   40    45    51    53   0.38900 -1.0 2.0
   40    45    51    53   0.16950  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    51   0.15000  1.0 3.0
   42    40    45    46   0.15000  1.0 3.0
   42    40    45    47   0.15000  1.0 3.0
   42    40    45    51   0.15000  1.0 3.0
   45    51   -53    33   3.62500 -1.0 2.0
   45    51    53    54   3.62500 -1.0 2.0
   46    45    51    52   0.33100  1.0 3.0
   46    45    51    53   0.00000  1.0 1.0
   47    45    51    52   0.33100  1.0 3.0
   47    45    51    53   0.00000  1.0 1.0
   51    53    54    55   0.00000  1.0 1.0
   51    53    54    56   2.08450  1.0 1.0
   51    53    54    56  -0.39300 -1.0 2.0
   51    53    54    56   0.23400  1.0 3.0
   51    53    54    66  -0.28000  1.0 1.0
   51    53    54    66  -1.16550 -1.0 2.0
   52    51    53    33   1.88100 -1.0 2.0
   52    51    53    54   1.88100 -1.0 2.0
   53    33    38    39   0.15000  1.0 3.0
   53    33   -38    40  -0.64600  1.0 1.0
   53    33   -38    40   0.58400 -1.0 2.0
   53    33    38    43  -2.10200  1.0 1.0
   53    33    38    43  -0.31600 -1.0 2.0
   53    33    38    43   0.13050  1.0 3.0
   53    54    56    57   0.15000  1.0 3.0
   53    54    56    58  -0.27100  1.0 1.0
   53    54    56    58  -0.01700 -1.0 2.0
   53    54    56    58  -0.48600  1.0 3.0
   53    54    56    60   2.76900  1.0 1.0
   53    54    56    60  -0.24350 -1.0 2.0
   53    54    56    60  -0.78250  1.0 3.0
   53    54    66    62  -2.37750  1.0 1.0
   53    54    66    62  -0.08150 -1.0 2.0
   53    54    66    62   0.59000  1.0 3.0
   54    56    58    59   0.15000  1.0 3.0
   54    56   -58    62   3.97050  1.0 1.0
   54    56    58    64   0.86500  1.0 1.0
   54    56    58    64  -0.17500 -1.0 2.0
   54    56    58    64   0.20800  1.0 3.0
   54    56    60    61  -0.11600  1.0 1.0
   54    56    60    61  -0.09450 -1.0 2.0
   54    56    60    61   0.21250  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    60   0.23400  1.0 3.0
   55    54    66    62   0.37050  1.0 3.0
   56    54   -66    62   0.06250  1.0 1.0
   56    54   -66    62  -0.01100 -1.0 2.0
   56    54   -66    62   0.28050  1.0 3.0
   56    58    62    63   0.15000  1.0 3.0
   56    58   -62    66   0.62750  1.0 1.0
   56    58   -62    66  -0.30950 -1.0 2.0
   56    58   -62    66   0.27300  1.0 3.0
   56    58    62    67   0.56750  1.0 1.0
   56    58    62    67  -0.07550 -1.0 2.0
   56    58    62    67   0.20000  1.0 3.0
   56    58    64    65  -0.11600  1.0 1.0
   56    58    64    65  -0.09450 -1.0 2.0
   56    58    64    65   0.21250  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    62   0.15000  1.0 3.0
   57    56    58    64   0.23400  1.0 3.0
   57    56    60    61   0.19450  1.0 3.0
   58    56    60    61  -0.11600  1.0 1.0
   58    56    60    61  -0.09450 -1.0 2.0
   58    56    60    61   0.21250  1.0 3.0
   58    62   -66    54   0.06250  1.0 1.0
   58    62   -66    54  -0.01100 -1.0 2.0
   58    62   -66    54   0.28050  1.0 3.0
   58    62    67    68   0.15000  1.0 3.0
   58    62    67    69   0.15000  1.0 3.0
   58    62    67    70   0.62750  1.0 1.0
   58    62    67    70  -0.30950 -1.0 2.0
   58    62    67    70   0.27300  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    66   0.23400  1.0 3.0
   59    58    62    67   0.15000  1.0 3.0
   59    58    64    65   0.19450  1.0 3.0
   62    58    64    65  -0.11600  1.0 1.0
   62    58    64    65  -0.09450 -1.0 2.0
   62    58    64    65   0.21250  1.0 3.0
   62    67    70    71  -2.65550  1.0 1.0
   62    67    70    71  -0.22350 -1.0 2.0
   62    67    70    71   0.24150  1.0 3.0
   63    62    66    54   0.37050  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    70   0.23400  1.0 3.0
   66    54    56    57   0.23400  1.0 3.0
   66    54   -56    58   0.62750  1.0 1.0
   66    54   -56    58  -0.30950 -1.0 2.0
   66    54   -56    58   0.27300  1.0 3.0
   66    54    56    60   3.69350  1.0 1.0
   66    54    56    60  -1.82950 -1.0 2.0
   66    62    67    68   0.23400  1.0 3.0
   66    62    67    69   0.23400  1.0 3.0
   66    62    67    70   1.11900  1.0 1.0
   66    62    67    70  -1.16350 -1.0 2.0
   66    62    67    70  -0.34150  1.0 3.0
   67    62    66    54   0.06250  1.0 1.0
   67    62    66    54  -0.01100 -1.0 2.0
   67    62    66    54   0.28050  1.0 3.0
   67    70    71    72   0.00000  1.0 1.0
   67    70    71    73   0.00000  1.0 1.0
   67    70    71    74   0.05050  1.0 1.0
   67    70    71    74  -1.30700 -1.0 2.0
   67    70    71    74   0.91550  1.0 3.0
   68    67    70    71   0.03000  1.0 3.0
   69    67    70    71   0.03000  1.0 3.0
   70    71    74    75   0.00000  1.0 1.0
   72    71    74    75   0.00000  1.0 1.0
   73    71    74    75   0.00000  1.0 1.0
   64    58    62    63   0.23400  1.0 3.0
   64    58    62    66   3.69350  1.0 1.0
   64    58    62    66  -1.82950 -1.0 2.0
   64    58    62    67   0.86500  1.0 1.0
   64    58    62    67  -0.17500 -1.0 2.0
   64    58    62    67   0.20800  1.0 3.0
   60    56    58    59   0.23400  1.0 3.0
   60    56    58    62   0.86500  1.0 1.0
   60    56    58    62  -0.17500 -1.0 2.0
   60    56    58    62   0.20800  1.0 3.0
   60    56    58    64   3.75450  1.0 1.0
   43    38    40    41  -0.11250  1.0 3.0
   43    38    40    42  -0.11250  1.0 3.0
   43    38    40    45  -0.95700  1.0 1.0
   43    38    40    45  -0.18200 -1.0 2.0
   43    38    40    45   0.29450  1.0 3.0
   44    43    48    49   2.45000 -1.0 2.0
   44    43    48    50   2.45000 -1.0 2.0
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
   36    30    35    37  10.50000 -1.0 2.0
   45    52    51    53  10.50000 -1.0 2.0
   33    54    53    51   1.00000 -1.0 2.0
   38    48    43    44  10.50000 -1.0 2.0
   50    43    48    49   1.00000 -1.0 2.0
END
