* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    130    205     386
    1     0 S   NP   _N1_     1    29.27078    95.71009   -18.03256
    2     1 S   H    _HN1     2     1.02965    89.07140    10.39589
    3     1 S   H    _H1_     3     1.02842    53.93724   122.49940
    4     1 S   H    _H2_     4     1.02799    66.06096  -100.04383
    5     1 S   CT   _CA1     5     1.50091   159.06811   170.30077
    6     5 S   HC   _HA1     6     1.09553   105.37913    19.60282
    7     5 S   CO3  _C1_     7     1.53780   112.22327  -101.00551
    8     7 S   O2Z  _O11     8     1.26427   115.31107   -47.59129
    9     7 S   O2Z  _O12     9     1.26240   115.33239   132.06973
   10     5 S   CT   _CB1    10     1.53139   107.42689   137.81121
   11    10 S   HC   HB11    11     1.09818   109.84273   -47.80219
   12    10 S   HC   HB12    12     1.09831   110.18088    68.82379
   13    10 S   CT   _CG1    13     1.53027   112.55879  -168.79681
   14    13 S   HC   HG11    14     1.09398   110.44069   -52.82719
   15    13 S   HC   HG12    15     1.09609   110.17309    66.11993
   16    13 S   C    _CD1    16     1.51760   111.94112  -173.57663
   17    16 S   O    _OE1    17     1.22753   123.00197   -16.60784
   18    16 S   N    _N2_    18     1.38551   111.88360   164.11664
   19    18 S   H    _HN2    19     1.01632   119.25368     1.91193
   20    18 S   CT1  _CA2    20     1.46273   123.38902  -177.00389
   21    20 S   HC   _HA2    21     1.09722   109.40740    -3.37852
   22    20 S   C    _C2_    22     1.53446   109.11431  -119.32417
   23    22 S   O    _O2_    23     1.23049   122.06842  -149.88524
   24    20 S   CT   _CB2    32     1.53445   110.90618   118.34150
   25    24 S   HC   HB21    33     1.09185   108.93332    58.63533
   26    24 S   HC   HB22    34     1.09520   110.69590   176.49759
   27    22 S   N    _N3_    24     1.38455   113.67917    37.73870
   28    27 S   H    _HN3    25     1.01492   118.92467    -0.80939
   29    24 S   S    _SG2    35     1.83156   111.19042   -64.40673
   30    27 S   CT   _CA3    26     1.45436   123.46241   175.28084
   31    30 S   HC   HA31    27     1.09523   109.26726    24.20056
   32    30 S   HC   HA32    28     1.09498   107.12169   141.17904
   33    29 S   CT   _C11    36     1.85028   102.06637   140.37184
   34    33 S   HC   _H4_    37     1.09537   106.30922   176.46875
   35    30 S   CO3  _C3_    29     1.52901   113.06861   -99.31374
   36    35 S   O2Z  _O31    30     1.26407   115.37752   -45.94467
   37    35 S   O2Z  _O32    31     1.26354   115.01492   135.01114
   38    33 S   CM   _C6_    38     1.50578   110.74145    60.01723
   39    38 S   CM   _C7_    39     1.34365   121.96504  -113.00757
   40    39 S   CO4  _C8_    40     1.49473   120.41800    -0.00000
   41    40 S   O    _O33    41     1.23390   118.72192   168.87843
   42    39 S   NE   _N5_    57     1.37754   123.19049   179.26725
   43    42 S   H    _H14    58     1.01703   116.65085   177.42207
   44    40 S   CMA  _C9_    42     1.52214   119.63947   -12.52768
   45    44 S   OM   _O36    43     1.26548   114.04057  -168.63403
   46    42 S   CT1  _C15    59     1.45164   123.77379    10.74422
   47    46 S   HC   _H6_    60     1.09608   108.74139    85.74461
   48    33 S   CM   _C10    44     1.51860   110.23767   -67.93507
   49    46 S   CT   _C4_    61     1.53213   108.96539   -33.94161
   50    49 S   HC   _H7_    62     1.09964   108.96856   -73.01533
   51    49 S   HC   _H8_    63     1.09747   109.72068   171.23541
   52    46 S   CO3  _C16    69     1.54130   107.72917  -159.17504
   53    52 S   O2Z  _O38    70     1.26373   116.41741   129.37599
   54    52 S   O2Z  _O37    71     1.26717   114.95562   -51.89889
   55    48 S   CT   _C12    45     1.53399   115.58213   -68.18453
   56    55 S   HC   _H9_    46     1.09817   108.16379   138.05074
   57    55 S   HC   _H10    47     1.09630   110.53580    24.45662
   58    38 S   CT   _C5_    64     1.52670   118.62211    66.46218
   59    58 S   HC   _H3_    65     1.09776   109.16091   -46.57781
   60    55 S   CT   _C13    48     1.53587   113.51214   -99.96709
   61    60 S   HC   _H5_    49     1.09541   111.38573   -45.85224
   62    58 S   CO3  _C17    66     1.53943   109.22006    70.27293
   63    62 S   O2Z  _O40    67     1.26225   116.66593    77.68096
   64    62 S   O2Z  _O39    68     1.26622   114.44073  -102.93620
   65    60 S   CO3  _C14    50     1.53792   111.74519    77.52720
   66    65 S   O2Z  _O35    51     1.26382   115.24291    62.33734
   67    65 S   O2Z  _O34    52     1.26269   114.92283  -119.72730
   68    60 S   NP   _N4_    53     1.50278   107.32345  -159.74820
   69    68 S   H    _H11    54     1.03001   112.05213    57.53288
   70    68 S   H    _H12    55     1.03246   111.23423   -62.06888
   71    68 S   H    _H13    56     1.02716   111.21485   178.31275
  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   8   5   4   3
  16   6   2   1   1  17  14   9   4  11   4   6   2  10   7   8
  10   5   4   3   1   1  11   5   4   4   3   8   7   2   1   1
   6   2   1   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    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    44    48    55    58  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    45    48    55    56    57    60    42    49    58    59    62  
   38    39    44    48    55    58  
   36    37  
   37  
    0  
   39    40    41    44    48    55    42    43    46    49    50    51    58    59    62    63    64  
   40    41    44    45    48    42    43    46    47    49    58    59    62    52  
   41    44    45    48    55    42    43    46    58  
   44    45    48    42  
   43    46    47    49    50    51    58    52    53    54    44  
   46    47    49    52  
   45    48    55    56    57    60  
   48    55  
   47    49    50    51    58    59    62    52    53    54  
   49    50    51    58    52    53    54  
   55    56    57    60    61    65    68    58  
   50    51    58    59    62    63    64    52    53    54  
   51    58    59    62    52  
   58    59    62    52  
   53    54    58  
   54  
    0  
   56    57    60    61    65    66    67    68    69    70    71  
   57    60    61    65    68  
   60    61    65    68  
   59    62    63    64  
   62    63    64  
   61    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   63    64  
   64  
    0  
   66    67    68    69    70    71  
   67    68  
   68  
   69    70    71  
   70    71  
   71  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
   66   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   67   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   68   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
   69   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   70   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   71   0.5000   0.0300   0.210000   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   317.000  1.510
   33    48   317.000  1.510
   38    39   549.000  1.340
   38    58   317.000  1.510
   39    40   320.000  1.462
   39    42   425.000  1.378
   40    41   570.000  1.229
   40    44   270.000  1.476
   44    45   745.000  1.250
   44    48   465.000  1.376
   48    55   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    65   317.000  1.522
   60    68   367.000  1.471
   65    66   656.000  1.250
   65    67   656.000  1.250
   68    69   434.000  1.010
   68    70   434.000  1.010
   68    71   434.000  1.010
   42    43   434.000  1.010
   42    46   382.000  1.448
   46    47   340.000  1.090
   46    49   268.000  1.529
   46    52   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   268.000  1.529
   58    59   340.000  1.090
   58    62   317.000  1.522
   62    63   656.000  1.250
   62    64   656.000  1.250
   52    53   656.000  1.250
   52    54   656.000  1.250
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  112.20000
   29    33    48    75.00000  112.20000
   33    38    39    70.00000  124.00000
   33    38    58    65.00000  117.92700
   33    48    44    70.00000  124.00000
   33    48    55    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  118.96000
   38    39    42    70.00000  124.03900
   38    58    49    70.00000  112.02700
   38    58    59    35.00000  109.50000
   38    58    62    65.00000  111.94000
   39    40    41    80.00000  123.72100
   39    40    44    65.00000  118.65900
   39    42    43    35.00000  114.50000
   39    42    46    50.00000  121.00000
   40    44    45    85.00000  116.28000
   40    44    48    65.00000  114.61000
   44    40    41    80.00000  120.81000
   44    48    55    70.00000  124.00000
   48    33    34    35.00000  109.50000
   48    33    38    70.00000  110.12100
   48    44    45    65.00000  137.10300
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    60    70.00000  112.02700
   55    60    61    37.50000  110.70000
   55    60    65    70.00000  109.69300
   55    60    68    80.00000  111.20000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    65    66    70.00000  117.00000
   60    65    67    70.00000  117.00000
   60    68    69    35.00000  109.50000
   60    68    70    35.00000  109.50000
   60    68    71    35.00000  109.50000
   65    60    61    35.00000  109.50000
   67    65    66    80.00000  126.00000
   68    60    61    35.00000  109.50000
   68    60    65    80.00000  109.26000
   70    68    69    35.00000  109.50000
   71    68    69    35.00000  109.50000
   71    68    70    35.00000  109.50000
   42    39    40    70.00000  117.92000
   42    46    47    35.00000  109.50000
   42    46    49    80.00000  111.61500
   42    46    52    63.00000  110.10000
   46    42    43    35.00000  112.50000
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    58    58.35000  112.70000
   46    52    53    70.00000  117.00000
   46    52    54    70.00000  117.00000
   49    46    47    37.50000  110.70000
   49    58    59    37.50000  110.70000
   49    58    62    70.00000  109.69300
   51    49    50    33.00000  107.80000
   58    38    39    70.00000  124.00000
   58    49    50    37.50000  110.70000
   58    49    51    37.50000  110.70000
   58    62    63    70.00000  117.00000
   58    62    64    70.00000  117.00000
   62    58    59    35.00000  109.50000
   64    62    63    80.00000  126.00000
   52    46    47    35.00000  109.50000
   52    46    49    63.00000  111.10000
   54    52    53    80.00000  126.00000
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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   0.81900  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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    58   0.30250  1.0 1.0
   29    33    38    58  -0.14950 -1.0 2.0
   29    33    38    58   0.36900  1.0 3.0
   29    33    48    44   0.42700  1.0 1.0
   29    33    48    44  -0.70350 -1.0 2.0
   29    33    48    44  -0.43150  1.0 3.0
   29    33    48    55   0.30250  1.0 1.0
   29    33    48    55  -0.14950 -1.0 2.0
   29    33    48    55   0.36900  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    58    49   0.46850  1.0 1.0
   33    38    58    49   0.08550 -1.0 2.0
   33    38    58    49   0.09800  1.0 3.0
   33    38    58    59   0.34800  1.0 3.0
   33    38    58    62   0.17250  1.0 1.0
   33    38    58    62  -0.04100 -1.0 2.0
   33    38    58    62  -0.33850  1.0 3.0
   33    48    55    56   0.34800  1.0 3.0
   33    48    55    57   0.34800  1.0 3.0
   33    48    55    60   0.46850  1.0 1.0
   33    48    55    60   0.08550 -1.0 2.0
   33    48    55    60   0.09800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    58   0.34800  1.0 3.0
   34    33    48    44   0.00000  1.0 1.0
   34    33    48    55   0.34800  1.0 3.0
   38    33    48    44  -0.28300  1.0 1.0
   38    33    48    44   0.26700 -1.0 2.0
   38    33    48    44  -0.63300  1.0 3.0
   38    33    48    55   0.09700  1.0 1.0
   38    33    48    55   0.15600 -1.0 2.0
   38    33    48    55  -0.50800  1.0 3.0
   38    39    40    41   1.00000 -1.0 2.0
   38    39   -40    44  -1.18350  1.0 1.0
   38    39   -40    44   1.45950 -1.0 2.0
   38    39    42    43   1.00000 -1.0 2.0
   38    39    42    46  -0.54700  1.0 1.0
   38    39    42    46   1.23000 -1.0 2.0
   38    58    62    63   0.30150 -1.0 2.0
   38    58    62    64   0.30150 -1.0 2.0
   39    38    58    49   0.09850  1.0 1.0
   39    38    58    49   0.15250 -1.0 2.0
   39    38    58    49  -0.50650  1.0 3.0
   39    38    58    59   0.00000  1.0 1.0
   39    38    58    62  -0.51250  1.0 1.0
   39    38    58    62  -0.88800 -1.0 2.0
   39    38    58    62   0.08850  1.0 3.0
   39    40    44    45   1.50000 -1.0 2.0
   39    40    44    48  -1.18350  1.0 1.0
   39    40    44    48   1.45950 -1.0 2.0
   39    42    46    47   0.00000  1.0 1.0
   39    42   -46    49   0.25450  1.0 1.0
   39    42   -46    49  -0.61700 -1.0 2.0
   39    42   -46    49  -0.23550  1.0 3.0
   39    42    46    52  -0.12500  1.0 1.0
   39    42    46    52  -0.12500 -1.0 2.0
   39    42    46    52   0.25000  1.0 3.0
   40    39    42    43   1.00000 -1.0 2.0
   40    39    42    46   1.00000 -1.0 2.0
   40    44   -48    33   7.00000 -1.0 2.0
   40    44    48    55   7.00000 -1.0 2.0
   41    40    44    45  -0.11900  1.0 1.0
   41    40    44    45   0.76850 -1.0 2.0
   41    40    44    45   0.14100  1.0 3.0
   41    40    44    48   1.00000 -1.0 2.0
   44    48    55    56   0.00000  1.0 1.0
   44    48    55    57   0.00000  1.0 1.0
   44    48    55    60   0.09850  1.0 1.0
   44    48    55    60   0.15250 -1.0 2.0
   44    48    55    60  -0.50650  1.0 3.0
   45    44    48    33   7.00000 -1.0 2.0
   45    44    48    55   7.00000 -1.0 2.0
   48    33   -38    39  -0.28300  1.0 1.0
   48    33   -38    39   0.26700 -1.0 2.0
   48    33   -38    39  -0.63300  1.0 3.0
   48    33    38    58   0.09700  1.0 1.0
   48    33    38    58   0.15600 -1.0 2.0
   48    33    38    58  -0.50800  1.0 3.0
   48    55    60    61   0.15000  1.0 3.0
   48    55    60    65  -0.98800  1.0 1.0
   48    55    60    65   0.48800 -1.0 2.0
   48    55    60    65   0.76800  1.0 3.0
   48    55    60    68  -0.47300  1.0 1.0
   48    55    60    68   0.29700 -1.0 2.0
   48    55    60    68   0.83300  1.0 3.0
   55    60    65    66   0.41150 -1.0 2.0
   55    60    65    67   0.41150 -1.0 2.0
   55    60    68    69   0.17350  1.0 3.0
   55    60    68    70   0.17350  1.0 3.0
   55    60    68    71   0.17350  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    65  -0.11250  1.0 3.0
   56    55    60    68   0.19200  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    65  -0.11250  1.0 3.0
   57    55    60    68   0.19200  1.0 3.0
   61    60    65    66   0.00000  1.0 1.0
   61    60    65    67   0.00000  1.0 1.0
   61    60    68    69   0.13050  1.0 3.0
   61    60    68    70   0.13050  1.0 3.0
   61    60    68    71   0.13050  1.0 3.0
   65    60    68    69   0.17350  1.0 3.0
   65    60    68    70   0.17350  1.0 3.0
   65    60    68    71   0.17350  1.0 3.0
   68    60    65    66   0.30150 -1.0 2.0
   68    60    65    67   0.30150 -1.0 2.0
   42    39    40    41  -0.52200  1.0 1.0
   42    39    40    41   0.82950 -1.0 2.0
   42    39    40    44   1.50000 -1.0 2.0
   42    46    49    50   0.22950  1.0 3.0
   42    46    49    51   0.22950  1.0 3.0
   42    46    49    58   1.26750  1.0 1.0
   42    46    49    58  -0.00950 -1.0 2.0
   42    46    49    58   0.30600  1.0 3.0
   42    46    52    53   0.00000  1.0 1.0
   42    46    52    54   0.00000  1.0 1.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    49   0.00000  1.0 1.0
   43    42    46    52   0.00000  1.0 1.0
   46    49   -58    38   0.34400  1.0 1.0
   46    49   -58    38   0.09450 -1.0 2.0
   46    49   -58    38   0.11100  1.0 3.0
   46    49    58    59   0.15000  1.0 3.0
   46    49    58    62  -0.84850  1.0 1.0
   46    49    58    62  -0.22800 -1.0 2.0
   46    49    58    62   0.29250  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    58   0.15000  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   49    46    52    53   0.00000  1.0 1.0
   49    46    52    54   0.00000  1.0 1.0
   49    58    62    63   0.41150 -1.0 2.0
   49    58    62    64   0.41150 -1.0 2.0
   50    49    58    38   0.15000  1.0 3.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    62  -0.11250  1.0 3.0
   51    49    58    38   0.15000  1.0 3.0
   51    49    58    59   0.15000  1.0 3.0
   51    49    58    62  -0.11250  1.0 3.0
   58    38    39    40   7.00000 -1.0 2.0
   58    38   -39    42   7.00000 -1.0 2.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    64   0.00000  1.0 1.0
   52    46    49    50  -0.03800  1.0 3.0
   52    46    49    51  -0.03800  1.0 3.0
   52    46    49    58  -0.84850  1.0 1.0
   52    46    49    58  -0.22800 -1.0 2.0
   52    46    49    58   0.29250  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
   36    30    35    37  10.50000 -1.0 2.0
   33    58    38    39   1.10000 -1.0 2.0
   40    42    39    38   1.10000 -1.0 2.0
   39    44    40    41  10.50000 -1.0 2.0
   40    45    44    48   1.10000 -1.0 2.0
   33    55    48    44   1.10000 -1.0 2.0
   66    60    65    67  10.50000 -1.0 2.0
   43    39    42    46   1.00000 -1.0 2.0
   63    58    62    64  10.50000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
END
