* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    115    183     350
    1     0 S   NP   _N1_     1    28.81527    94.11335   -17.70234
    2     1 S   H    _HN1     2     1.02787    65.11463   -92.29704
    3     1 S   H    _H1_     3     1.02954   102.74871    12.14812
    4     1 S   H    _H2_     4     1.02833    46.81791   113.74810
    5     1 S   CT   _CA1     5     1.50190   145.11680   174.08298
    6     5 S   HC   _HA1     6     1.09566   105.20080    16.80128
    7     5 S   CO3  _C1_     7     1.54109   112.15781  -103.28023
    8     7 S   O2Z  _O11     8     1.26476   115.37952   -43.20603
    9     7 S   O2Z  _O12     9     1.26271   115.03952   135.81092
   10     5 S   CT   _CB1    10     1.53177   107.31616   134.67880
   11    10 S   HC   HB11    11     1.09824   109.90946   -47.02500
   12    10 S   HC   HB12    12     1.09755   109.89025    69.26211
   13    10 S   CT   _CG1    13     1.53142   112.80065  -167.91489
   14    13 S   HC   HG11    14     1.09512   110.50664   -49.82980
   15    13 S   HC   HG12    15     1.09604   110.11037    68.93865
   16    13 S   C    _CD1    16     1.52065   112.07736  -170.72379
   17    16 S   O    _OE1    17     1.22752   123.08990   -18.84601
   18    16 S   N    _N2_    18     1.38490   111.79378   161.30973
   19    18 S   H    _HN2    19     1.01586   118.82526     6.77396
   20    18 S   CT1  _CA2    20     1.45825   123.84175  -177.89773
   21    20 S   HC   _HA2    21     1.09676   109.43924     0.70249
   22    20 S   C    _C2_    22     1.52809   106.59856  -116.44692
   23    22 S   O    _O2_    23     1.22965   122.80512   -27.52314
   24    20 S   CT   _CB2    32     1.53512   111.93203   124.11234
   25    24 S   HC   HB21    33     1.09540   110.67972    50.94690
   26    24 S   HC   HB22    34     1.09553   110.24315   168.74156
   27    22 S   N    _N3_    24     1.38590   112.47075   155.37656
   28    27 S   H    _HN3    25     1.01500   119.74825     1.04230
   29    24 S   S    _SG2    35     1.83117   111.79116   -72.95060
   30    27 S   CT   _CA3    26     1.45445   122.73736   175.38221
   31    30 S   HC   HA31    27     1.09545   108.84239    32.30753
   32    30 S   HC   HA32    28     1.09477   107.20606   149.41993
   33    29 S   CT   _C9_    36     1.85105   100.79681   126.19335
   34    33 S   HC   _H8_    37     1.09802   105.21859    46.11688
   35    30 S   CO3  _C3_    29     1.53061   113.63421   -90.62900
   36    35 S   O2Z  _O31    30     1.26371   115.82050   -31.29768
   37    35 S   O2Z  _O32    31     1.26410   114.67939   149.53534
   38    33 S   CT   _C4_    38     1.54818   111.96175   -72.13073
   39    38 S   HC   _H3_    39     1.09375   109.45139    43.87332
   40    38 S   CT   _C5_    40     1.54213   113.14247   -77.33500
   41    40 S   HC   _H4_    41     1.09417   108.07405  -172.91465
   42    38 S   NTH2 _N7_    63     1.47136   110.01837   159.98024
   43    42 S   H    _H17    64     1.01960   109.66582   -57.79850
   44    42 S   H    _H18    65     1.01989   109.53373  -173.97221
   45    40 S   CT   _C6_    42     1.53720   114.12984   -50.63692
   46    45 S   HC   _H5_    43     1.09838   108.92371   168.25637
   47    40 S   OH   _O35    61     1.42670   110.49830    72.57032
   48    47 S   HO   _H16    62     0.97405   108.23951   -66.77110
   49    45 S   CT   _C7_    44     1.54277   112.05807    50.84858
   50    49 S   HC   _H6_    45     1.09724   108.10116  -170.47024
   51    45 S   NG   _N4_    52     1.48148   111.66502   -74.20058
   52    51 S   H    _H11    53     1.01739   118.49696   108.40760
   53    33 S   CT   _C8_    46     1.54792   110.06358   161.69797
   54    53 S   HC   _H7_    47     1.09756   108.91683   -44.19116
   55    49 S   OH   _O34    50     1.42716   108.38524    74.18100
   56    55 S   HO   _H10    51     0.97285   107.82891   177.71107
   57    51 S   CG   _C10    54     1.38598   124.09111   -72.07292
   58    53 S   OH   _O33    48     1.43232   108.60406  -159.15759
   59    58 S   HO   _H9_    49     0.97295   107.45243   165.84660
   60    57 S   NG   _N6_    55     1.38153   118.85750   179.42054
   61    60 S   H    _H14    56     1.01580   121.30286    -0.57267
   62    60 S   H    _H15    57     1.01592   121.12385  -179.96044
   63    57 S   NG   _N5_    58     1.38042   122.41724    -0.74939
   64    63 S   H    _H12    59     1.01573   121.07160   179.24437
   65    63 S   H    _H13    60     1.01873   122.83118     1.63901
  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  10   5   4   3
  17   8   2   1   1  15   8  15   7   5   1   1  15   8   3   1
  10   6  10   3   5   3   2   1   6   1   1   5   2   1   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    49    53    54    58    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    49    50    53    54    58    59    55    47    42    43    44  
   38    39    40    49    53    54    58    42  
   36    37  
   37  
    0  
   39    40    41    45    46    49    53    54    58    51    47    48    42    43    44  
   40    41    45    53    47    42    43    44  
   41    45    46    49    50    53    55    51    52    57    47    48    42    43    44  
   45    46    49    51    47    48    42  
   43    44    45    47    53  
   44  
    0  
   46    49    50    53    54    58    55    56    51    52    57    60    63    47    48  
   49    50    53    55    51    52    57    47  
   48    49    51  
    0  
   50    53    54    58    59    55    56    51    52    57  
   53    54    58    55    56    51  
   52    57    60    61    62    63    64    65    53    55  
   57    60    63  
   54    58    59    55    56  
   58    59    55  
   56    58  
    0  
   60    61    62    63    64    65  
   59  
    0  
   61    62    63    64    65  
   62    63  
   63  
   64    65  
   65  
    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   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.275000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   44   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.133000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.275000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.2500   0.1700  -0.528167   2.1120   1.8750   0.051222218  -2.220205820
   52   0.5000   0.0300   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   2.2500   0.0500   0.837600   2.1120   1.8750   0.001000000  -0.126889456
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.913767   2.1120   1.8750   0.051222218  -2.220205820
   61   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   62   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.2500   0.1700  -0.913767   2.2900   2.0360   0.003973653   1.685851020
   64   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   65   0.5000   0.0300   0.460000   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   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   300.000  1.468
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    47   320.000  1.410
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   337.000  1.463
   49    50   340.000  1.090
   49    53   268.000  1.529
   49    55   320.000  1.410
   53    54   340.000  1.090
   53    58   320.000  1.410
   58    59   553.000  0.945
   55    56   553.000  0.945
   51    52   434.000  1.010
   51    57   481.000  1.340
   57    60   481.000  1.340
   57    63   481.000  1.340
   60    61   434.000  1.010
   60    62   434.000  1.010
   63    64   434.000  1.010
   63    65   434.000  1.010
   47    48   553.000  0.945
   42    43   495.000  1.019
   42    44   495.000  1.019
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    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    80.00000  112.76400
   33    53    49    58.35000  112.70000
   33    53    54    37.50000  110.70000
   33    53    58    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    40    47    50.00000  109.50000
   38    42    43    50.00000  110.30900
   38    42    44    50.00000  110.30900
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    49    58.35000  112.70000
   40    45    51    80.00000  111.20000
   40    47    48    55.00000  108.50000
   45    40    41    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    53    58.35000  112.70000
   45    49    55    50.00000  109.50000
   45    51    52    35.00000  118.40000
   45    51    57    50.00000  123.20000
   49    45    46    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    58    50.00000  109.50000
   49    55    56    55.00000  108.50000
   53    33    34    37.50000  110.70000
   53    33    38    58.35000  112.70000
   53    49    50    37.50000  110.70000
   53    58    59    55.00000  108.50000
   58    53    54    35.00000  109.50000
   55    49    50    35.00000  109.50000
   55    49    53    50.00000  109.50000
   51    45    46    35.00000  109.50000
   51    45    49    80.00000  111.20000
   51    57    60    70.00000  120.00000
   51    57    63    70.00000  120.00000
   57    51    52    35.00000  120.00000
   57    60    61    35.00000  120.00000
   57    60    62    35.00000  120.00000
   57    63    64    35.00000  120.00000
   57    63    65    35.00000  120.00000
   62    60    61    35.00000  120.00000
   63    57    60    70.00000  120.00000
   65    63    64    35.00000  120.00000
   47    40    41    35.00000  109.50000
   47    40    45    50.00000  109.50000
   42    38    39    50.00000  110.79000
   42    38    40    80.00000  112.76400
   44    42    43    40.00000  106.77200
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    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    53    49   0.44750  1.0 1.0
   29    33    53    49  -0.17800 -1.0 2.0
   29    33    53    49   0.20200  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    58   0.56750  1.0 1.0
   29    33    53    58  -0.07550 -1.0 2.0
   29    33    53    58   0.20000  1.0 3.0
   33    38    40    41   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    40    47   0.86500  1.0 1.0
   33    38    40    47  -0.17500 -1.0 2.0
   33    38    40    47   0.20800  1.0 3.0
   33    38    42    43   0.21650  1.0 1.0
   33    38    42    43   0.26250 -1.0 2.0
   33    38    42    43   0.12450  1.0 3.0
   33    38    42    44   0.21650  1.0 1.0
   33    38    42    44   0.26250 -1.0 2.0
   33    38    42    44   0.12450  1.0 3.0
   33    53    58    59  -0.11600  1.0 1.0
   33    53    58    59  -0.09450 -1.0 2.0
   33    53    58    59   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    53    49   0.15000  1.0 3.0
   34    33    53    54   0.15000  1.0 3.0
   34    33    53    58   0.23400  1.0 3.0
   38    33    53    49   0.56750  1.0 1.0
   38    33    53    49  -0.07550 -1.0 2.0
   38    33    53    49   0.20000  1.0 3.0
   38    33    53    54   0.15000  1.0 3.0
   38    33    53    58   0.86500  1.0 1.0
   38    33    53    58  -0.17500 -1.0 2.0
   38    33    53    58   0.20800  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40   -45    49   0.56750  1.0 1.0
   38    40   -45    49  -0.07550 -1.0 2.0
   38    40   -45    49   0.20000  1.0 3.0
   38    40    45    51   0.86200  1.0 1.0
   38    40    45    51   0.12850 -1.0 2.0
   38    40    45    51   0.15950  1.0 3.0
   38    40    47    48  -0.11600  1.0 1.0
   38    40    47    48  -0.09450 -1.0 2.0
   38    40    47    48   0.21250  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    40    47   0.23400  1.0 3.0
   39    38    42    43   0.20000  1.0 3.0
   39    38    42    44   0.20000  1.0 3.0
   40    38    42    43   0.21650  1.0 1.0
   40    38    42    43   0.26250 -1.0 2.0
   40    38    42    43   0.12450  1.0 3.0
   40    38    42    44   0.21650  1.0 1.0
   40    38    42    44   0.26250 -1.0 2.0
   40    38    42    44   0.12450  1.0 3.0
   40    45    49    50   0.15000  1.0 3.0
   40    45    49    53   0.56750  1.0 1.0
   40    45    49    53  -0.07550 -1.0 2.0
   40    45    49    53   0.20000  1.0 3.0
   40    45    49    55   0.86500  1.0 1.0
   40    45    49    55  -0.17500 -1.0 2.0
   40    45    49    55   0.20800  1.0 3.0
   40    45    51    52  -0.09500  1.0 1.0
   40    45    51    52  -0.20850 -1.0 2.0
   40    45    51    52   0.20900  1.0 3.0
   40    45    51    57   0.25550 -1.0 2.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    49   0.15000  1.0 3.0
   41    40    45    51  -0.29100  1.0 3.0
   41    40    47    48   0.19450  1.0 3.0
   45    40    47    48  -0.11600  1.0 1.0
   45    40    47    48  -0.09450 -1.0 2.0
   45    40    47    48   0.21250  1.0 3.0
   45    49   -53    33   0.56750  1.0 1.0
   45    49   -53    33  -0.07550 -1.0 2.0
   45    49   -53    33   0.20000  1.0 3.0
   45    49    53    54   0.15000  1.0 3.0
   45    49    53    58   0.86500  1.0 1.0
   45    49    53    58  -0.17500 -1.0 2.0
   45    49    53    58   0.20800  1.0 3.0
   45    49    55    56  -0.11600  1.0 1.0
   45    49    55    56  -0.09450 -1.0 2.0
   45    49    55    56   0.21250  1.0 3.0
   45    51    57    60   3.96800 -1.0 2.0
   45    51    57    63   3.96800 -1.0 2.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    53   0.15000  1.0 3.0
   46    45    49    55   0.23400  1.0 3.0
   46    45    51    52   0.00000  1.0 1.0
   46    45    51    57   0.08850  1.0 3.0
   49    45    51    52  -0.09500  1.0 1.0
   49    45    51    52  -0.20850 -1.0 2.0
   49    45    51    52   0.20900  1.0 3.0
   49    45    51    57   0.25550 -1.0 2.0
   49    53    58    59  -0.11600  1.0 1.0
   49    53    58    59  -0.09450 -1.0 2.0
   49    53    58    59   0.21250  1.0 3.0
   50    49    53    33   0.15000  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    58   0.23400  1.0 3.0
   50    49    55    56   0.19450  1.0 3.0
   53    33    38    39   0.15000  1.0 3.0
   53    33   -38    40   0.56750  1.0 1.0
   53    33   -38    40  -0.07550 -1.0 2.0
   53    33   -38    40   0.20000  1.0 3.0
   53    33    38    42   1.85550  1.0 1.0
   53    33    38    42  -0.84100 -1.0 2.0
   53    49    55    56  -0.11600  1.0 1.0
   53    49    55    56  -0.09450 -1.0 2.0
   53    49    55    56   0.21250  1.0 3.0
   54    53    58    59   0.19450  1.0 3.0
   55    49    53    33   0.86500  1.0 1.0
   55    49    53    33  -0.17500 -1.0 2.0
   55    49    53    33   0.20800  1.0 3.0
   55    49    53    54   0.23400  1.0 3.0
   55    49    53    58   3.75450  1.0 1.0
   51    45    49    50  -0.29100  1.0 3.0
   51    45    49    53   0.86200  1.0 1.0
   51    45    49    53   0.12850 -1.0 2.0
   51    45    49    53   0.15950  1.0 3.0
   51    45    49    55   4.07950  1.0 1.0
   51    45    49    55  -0.26450 -1.0 2.0
   51    45    49    55  -0.12150  1.0 3.0
   51    57    60    61   1.50000 -1.0 2.0
   51    57    60    62   1.50000 -1.0 2.0
   51    57    63    64   1.50000 -1.0 2.0
   51    57    63    65   1.50000 -1.0 2.0
   52    51    57    60   1.50000 -1.0 2.0
   52    51    57    63   1.50000 -1.0 2.0
   60    57    63    64   1.50000 -1.0 2.0
   60    57    63    65   1.50000 -1.0 2.0
   63    57    60    61   1.50000 -1.0 2.0
   63    57    60    62   1.50000 -1.0 2.0
   47    40    45    46   0.23400  1.0 3.0
   47    40    45    49   0.86500  1.0 1.0
   47    40    45    49  -0.17500 -1.0 2.0
   47    40    45    49   0.20800  1.0 3.0
   47    40    45    51   4.07950  1.0 1.0
   47    40    45    51  -0.26450 -1.0 2.0
   47    40    45    51  -0.12150  1.0 3.0
   42    38    40    41   0.15000  1.0 3.0
   42    38    40    45   1.85550  1.0 1.0
   42    38    40    45  -0.84100 -1.0 2.0
   42    38    40    47   5.28650  1.0 1.0
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
   52    57    51    45   1.00000 -1.0 2.0
   51    60    57    63  10.50000 -1.0 2.0
   62    57    60    61   1.00000 -1.0 2.0
   64    65    63    57   1.00000 -1.0 2.0
END
