* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    142    219     419
    1     0 S   NP   _N1_     1    28.96871   100.02279   -23.21330
    2     1 S   H    _HN1     2     1.02948    45.48313    26.74648
    3     1 S   H    _H1_     3     1.02825    65.93788   179.74131
    4     1 S   H    _H2_     4     1.02804   103.07505   -76.28483
    5     1 S   CT   _CA1     5     1.50137   143.23822    86.84465
    6     5 S   HC   _HA1     6     1.09575   105.14806   136.53639
    7     5 S   CO3  _C1_     7     1.53758   112.44614    16.30473
    8     7 S   O2Z  _O11     8     1.26384   115.00317   -43.02187
    9     7 S   O2Z  _O12     9     1.26231   114.93963   135.91444
   10     5 S   CT   _CB1    10     1.53038   107.38900  -105.48130
   11    10 S   HC   HB11    11     1.09852   109.33395   -48.91450
   12    10 S   HC   HB12    12     1.09812   110.48241    67.66324
   13    10 S   CT   _CG1    13     1.53056   112.67169  -169.80183
   14    13 S   HC   HG11    14     1.09556   110.84466   -68.34569
   15    13 S   HC   HG12    15     1.09661   109.62882    50.92440
   16    13 S   C    _CD1    16     1.51815   111.64588   171.52664
   17    16 S   O    _OE1    17     1.22787   123.01588    18.42941
   18    16 S   N    _N2_    18     1.38625   112.05851  -161.63314
   19    18 S   H    _HN2    19     1.01584   119.10416     0.46182
   20    18 S   CT1  _CA2    20     1.46214   123.28554   175.70700
   21    20 S   HC   _HA2    21     1.09747   109.20297     9.72207
   22    20 S   C    _C2_    22     1.53755   109.20239  -105.79798
   23    22 S   O    _O2_    23     1.23101   122.17553  -150.98245
   24    20 S   CT   _CB2    32     1.53241   111.69306   131.63280
   25    24 S   HC   HB21    33     1.09565   110.25643    56.71966
   26    24 S   HC   HB22    34     1.09380   109.87925   175.62816
   27    22 S   N    _N3_    24     1.38283   113.99217    36.55099
   28    27 S   H    _HN3    25     1.01516   119.61794    -3.29218
   29    24 S   S    _SG2    35     1.82624   111.61111   -64.16986
   30    27 S   CT   _CA3    26     1.45268   123.36860   177.24302
   31    30 S   HC   HA31    27     1.09545   107.52574   -64.78392
   32    30 S   HC   HA32    28     1.09554   108.00019    51.69680
   33    29 S   CT   _C15    36     1.85644    99.41633  -175.81718
   34    33 S   HC   _H6_    37     1.09614   106.85152   -10.81409
   35    30 S   CO3  _C3_    29     1.52995   113.98436   173.69307
   36    35 S   O2Z  _O31    30     1.26397   116.08428    -0.07913
   37    35 S   O2Z  _O32    31     1.26423   114.41981   179.97202
   38    33 S   CT   _C8_    38     1.56057   111.71238   106.80699
   39    38 S   HC   _H4_    39     1.09880   107.42110  -177.78822
   40    33 S   CT   _C16    66     1.54701   108.13897  -126.93030
   41    40 S   HC   _H7_    67     1.09805   110.13891   -58.19966
   42    38 S   CM   _C9_    40     1.50910   113.77526   -61.63946
   43    38 S   CT   _C7_    55     1.55160   114.21544    65.07531
   44    43 S   HC   _H13    56     1.09604   109.79635    68.61061
   45    43 S   HC   _H14    57     1.09597   111.51388   -48.98566
   46    40 S   CO3  _C18    68     1.54631   113.64445    63.83951
   47    46 S   O2Z  _O34    69     1.26336   116.15327    42.19600
   48    46 S   O2Z  _O33    70     1.26497   114.50633  -138.39670
   49    40 S   CT   _C17    71     1.53225   113.14653  -179.46405
   50    49 S   HC   _H22    72     1.09597   111.45865   -49.94317
   51    49 S   HC   _H23    73     1.09425   111.17484    70.53629
   52    49 S   HC   _H24    74     1.09634   111.62636  -170.32510
   53    42 S   CM   _C10    41     1.34152   129.86072   -74.17636
   54    53 S   CT   _C11    42     1.49922   111.46104  -174.21287
   55    54 S   HC   _H15    43     1.09508   110.37088   108.12936
   56    54 S   HC   _H16    44     1.09447   112.03124  -130.36146
   57    53 S   CT   _C14    62     1.48757   128.59270     2.87862
   58    57 S   HC   _H19    63     1.09447   110.18573   118.33329
   59    57 S   HC   _H20    64     1.09348   112.41812    -2.05405
   60    57 S   HC   _H21    65     1.09464   110.24142  -122.01425
   61    54 S   CT   _C12    45     1.52877   103.47415   -10.93665
   62    61 S   HC   _H17    46     1.09343   112.72623   144.43789
   63    61 S   HC   _H18    47     1.09922   108.48741   -98.45130
   64    42 S   CT   _C13    48     1.50222   117.89433   113.42432
   65    64 S   HC   _H5_    49     1.09786   109.77014   -58.68823
   66    64 S   CT   _C5_    50     1.54465   109.80975    60.00167
   67    66 S   HC   _H3_    51     1.09878   106.70449  -159.22924
   68    66 S   CT   _C6_    52     1.55389   111.44496   -42.00563
   69    68 S   HC   _H11    53     1.09695   109.05486  -135.35401
   70    68 S   HC   _H12    54     1.09807   110.30182   108.64630
   71    66 S   CT   _C4_    58     1.53315   115.16562    82.90219
   72    71 S   HC   _H8_    59     1.09475   111.62549   -59.00937
   73    71 S   HC   _H9_    60     1.09589   110.40379  -178.80613
   74    71 S   HC   _H10    61     1.09352   111.66032    62.43831
  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
  19   8   2   1   1  19   8  10   7  20  10   5   4   6   2   1
   3   2   1   1  13  12   6   5   5   2   1   1   8   4   3  10
   4   8   7   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    43    40    41    46    49  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    53    64    68    43    44    45    40    41    46    47    48    49    50    51    52  
   38    39    42    43    40    41    46    49  
   36    37  
   37  
    0  
   39    42    53    54    61    64    65    66    68    69    70    43    44    45    57    40    41    46    49  
   42    53    64    68    43    44    45    40  
   41    46    47    48    49    50    51    52    42    43  
   46    47    48    49    50    51    52  
   53    54    55    56    61    62    63    64    65    66    67    68    43    44    45    71    57    58    59    60  
   44    45    71    53    64    66    67    68    69    70  
   45    66    68    69    70  
   66    68    69    70  
   47    48    49    50    51    52  
   48    49  
   49  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    61    62    63    64    65    66    57    58    59    60  
   55    56    61    62    63    64    65    66    57    58    59    60  
   56    61    62    63    64    57  
   61    62    63    64    57  
   58    59    60    61    64  
   59    60  
   60  
    0  
   62    63    64    65    66    67    68    71  
   63    64    65    66  
   64    65    66  
   65    66    67    68    69    70    71    72    73    74  
   66    67    68    71  
   67    68    69    70    71    72    73    74  
   68    69    70    71    72    73    74  
   69    70    71    72    73    74  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    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  -0.060000   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  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    40   268.000  1.529
   38    39   340.000  1.090
   38    42   317.000  1.510
   38    43   268.000  1.529
   42    53   549.000  1.340
   42    64   317.000  1.510
   53    54   317.000  1.510
   53    57   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   340.000  1.090
   64    66   268.000  1.529
   66    67   340.000  1.090
   66    68   268.000  1.529
   66    71   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   40    41   340.000  1.090
   40    46   317.000  1.522
   40    49   268.000  1.529
   46    47   656.000  1.250
   46    48   656.000  1.250
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    70.00000  112.02700
   33    38    43    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    46    70.00000  109.69300
   33    40    49    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    42    53    70.00000  124.00000
   38    42    64    65.00000  117.92700
   38    43    68    58.35000  112.70000
   38    43    44    37.50000  110.70000
   38    43    45    37.50000  110.70000
   42    38    39    35.00000  109.50000
   42    53    54    70.00000  124.00000
   42    53    57    70.00000  124.00000
   42    64    61    70.00000  112.02700
   42    64    65    35.00000  109.50000
   42    64    66    70.00000  112.02700
   53    54    55    35.00000  109.50000
   53    54    56    35.00000  109.50000
   53    54    61    70.00000  112.02700
   53    57    58    35.00000  109.50000
   53    57    59    35.00000  109.50000
   53    57    60    35.00000  109.50000
   54    61    62    37.50000  110.70000
   54    61    63    37.50000  110.70000
   54    61    64    58.35000  112.70000
   56    54    55    33.00000  107.80000
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   61    64    65    37.50000  110.70000
   61    64    66    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    42    53    70.00000  124.00000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    66    67    37.50000  110.70000
   64    66    68    58.35000  112.70000
   64    66    71    58.35000  112.70000
   66    64    65    37.50000  110.70000
   66    68    69    37.50000  110.70000
   66    68    70    37.50000  110.70000
   66    68    43    58.35000  112.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    37.50000  110.70000
   68    66    67    37.50000  110.70000
   68    43    44    37.50000  110.70000
   68    43    45    37.50000  110.70000
   70    68    69    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    42    70.00000  112.02700
   43    68    69    37.50000  110.70000
   43    68    70    37.50000  110.70000
   45    43    44    33.00000  107.80000
   71    66    67    37.50000  110.70000
   71    66    68    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   57    53    54    65.00000  117.92700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    46    47    70.00000  117.00000
   40    46    48    70.00000  117.00000
   40    49    50    37.50000  110.70000
   40    49    51    37.50000  110.70000
   40    49    52    37.50000  110.70000
   46    40    41    35.00000  109.50000
   48    46    47    80.00000  126.00000
   49    40    41    37.50000  110.70000
   49    40    46    70.00000  109.69300
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    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    38    43   0.44750  1.0 1.0
   29    33    38    43  -0.17800 -1.0 2.0
   29    33    38    43   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    46   0.56750  1.0 1.0
   29    33    40    46  -0.07550 -1.0 2.0
   29    33    40    46   0.20000  1.0 3.0
   29    33    40    49   0.44750  1.0 1.0
   29    33    40    49  -0.17800 -1.0 2.0
   29    33    40    49   0.20200  1.0 3.0
   33    38    42    53   0.09850  1.0 1.0
   33    38    42    53   0.15250 -1.0 2.0
   33    38    42    53  -0.50650  1.0 3.0
   33    38    42    64   0.46850  1.0 1.0
   33    38    42    64   0.08550 -1.0 2.0
   33    38    42    64   0.09800  1.0 3.0
   33    38    43    68   0.56750  1.0 1.0
   33    38    43    68  -0.07550 -1.0 2.0
   33    38    43    68   0.20000  1.0 3.0
   33    38    43    44   0.15000  1.0 3.0
   33    38    43    45   0.15000  1.0 3.0
   33    40    46    47   0.41150 -1.0 2.0
   33    40    46    48   0.41150 -1.0 2.0
   33    40    49    50   0.15000  1.0 3.0
   33    40    49    51   0.15000  1.0 3.0
   33    40    49    52   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    43   0.15000  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    46  -0.11250  1.0 3.0
   34    33    40    49   0.15000  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    46  -1.63150  1.0 1.0
   38    33    40    46  -0.43550 -1.0 2.0
   38    33    40    46   0.24500  1.0 3.0
   38    33    40    49   0.56750  1.0 1.0
   38    33    40    49  -0.07550 -1.0 2.0
   38    33    40    49   0.20000  1.0 3.0
   38    42    53    54   7.00000 -1.0 2.0
   38    42    53    57   7.00000 -1.0 2.0
   38    42    64    61   0.46850  1.0 1.0
   38    42    64    61   0.08550 -1.0 2.0
   38    42    64    61   0.09800  1.0 3.0
   38    42    64    65   0.34800  1.0 3.0
   38    42    64    66   0.46850  1.0 1.0
   38    42    64    66   0.08550 -1.0 2.0
   38    42    64    66   0.09800  1.0 3.0
   39    38    42    53   0.00000  1.0 1.0
   39    38    42    64   0.34800  1.0 3.0
   39    38    43    68   0.15000  1.0 3.0
   39    38    43    44   0.15000  1.0 3.0
   39    38    43    45   0.15000  1.0 3.0
   42    38    43    68   0.34400  1.0 1.0
   42    38    43    68   0.09450 -1.0 2.0
   42    38    43    68   0.11100  1.0 3.0
   42    38    43    44   0.15000  1.0 3.0
   42    38    43    45   0.15000  1.0 3.0
   42    53    54    55   0.00000  1.0 1.0
   42    53    54    56   0.00000  1.0 1.0
   42    53   -54    61   0.09850  1.0 1.0
   42    53   -54    61   0.15250 -1.0 2.0
   42    53   -54    61  -0.50650  1.0 3.0
   42    53    57    58   0.00000  1.0 1.0
   42    53    57    59   0.00000  1.0 1.0
   42    53    57    60   0.00000  1.0 1.0
   42    64    66    67   0.15000  1.0 3.0
   42    64   -66    68   0.34400  1.0 1.0
   42    64   -66    68   0.09450 -1.0 2.0
   42    64   -66    68   0.11100  1.0 3.0
   42    64    66    71   0.34400  1.0 1.0
   42    64    66    71   0.09450 -1.0 2.0
   42    64    66    71   0.11100  1.0 3.0
   53    42   -64    61   0.09850  1.0 1.0
   53    42   -64    61   0.15250 -1.0 2.0
   53    42   -64    61  -0.50650  1.0 3.0
   53    42    64    65   0.00000  1.0 1.0
   53    42    64    66   0.09850  1.0 1.0
   53    42    64    66   0.15250 -1.0 2.0
   53    42    64    66  -0.50650  1.0 3.0
   53    54    61    62   0.15000  1.0 3.0
   53    54    61    63   0.15000  1.0 3.0
   53    54   -61    64   0.34400  1.0 1.0
   53    54   -61    64   0.09450 -1.0 2.0
   53    54   -61    64   0.11100  1.0 3.0
   54    53    57    58   0.34800  1.0 3.0
   54    53    57    59   0.34800  1.0 3.0
   54    53    57    60   0.34800  1.0 3.0
   54    61   -64    42   0.34400  1.0 1.0
   54    61   -64    42   0.09450 -1.0 2.0
   54    61   -64    42   0.11100  1.0 3.0
   54    61    64    65   0.15000  1.0 3.0
   54    61    64    66   0.56750  1.0 1.0
   54    61    64    66  -0.07550 -1.0 2.0
   54    61    64    66   0.20000  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    64   0.15000  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   56    54    61    64   0.15000  1.0 3.0
   61    64    66    67   0.15000  1.0 3.0
   61    64    66    68   0.56750  1.0 1.0
   61    64    66    68  -0.07550 -1.0 2.0
   61    64    66    68   0.20000  1.0 3.0
   61    64    66    71   0.56750  1.0 1.0
   61    64    66    71  -0.07550 -1.0 2.0
   61    64    66    71   0.20000  1.0 3.0
   62    61    64    42   0.15000  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   63    61    64    42   0.15000  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   64    42   -53    54   7.00000 -1.0 2.0
   64    42    53    57   7.00000 -1.0 2.0
   64    66    68    69   0.15000  1.0 3.0
   64    66    68    70   0.15000  1.0 3.0
   64    66    68    43   0.56750  1.0 1.0
   64    66    68    43  -0.07550 -1.0 2.0
   64    66    68    43   0.20000  1.0 3.0
   64    66    71    72   0.15000  1.0 3.0
   64    66    71    73   0.15000  1.0 3.0
   64    66    71    74   0.15000  1.0 3.0
   65    64    66    67   0.15000  1.0 3.0
   65    64    66    68   0.15000  1.0 3.0
   65    64    66    71   0.15000  1.0 3.0
   66    68   -43    38   0.56750  1.0 1.0
   66    68   -43    38  -0.07550 -1.0 2.0
   66    68   -43    38   0.20000  1.0 3.0
   66    68    43    44   0.15000  1.0 3.0
   66    68    43    45   0.15000  1.0 3.0
   67    66    68    69   0.15000  1.0 3.0
   67    66    68    70   0.15000  1.0 3.0
   67    66    68    43   0.15000  1.0 3.0
   67    66    71    72   0.15000  1.0 3.0
   67    66    71    73   0.15000  1.0 3.0
   67    66    71    74   0.15000  1.0 3.0
   68    66    71    72   0.15000  1.0 3.0
   68    66    71    73   0.15000  1.0 3.0
   68    66    71    74   0.15000  1.0 3.0
   69    68    43    38   0.15000  1.0 3.0
   69    68    43    44   0.15000  1.0 3.0
   69    68    43    45   0.15000  1.0 3.0
   70    68    43    38   0.15000  1.0 3.0
   70    68    43    44   0.15000  1.0 3.0
   70    68    43    45   0.15000  1.0 3.0
   43    38    42    53   0.09850  1.0 1.0
   43    38    42    53   0.15250 -1.0 2.0
   43    38    42    53  -0.50650  1.0 3.0
   43    38   -42    64   0.46850  1.0 1.0
   43    38   -42    64   0.08550 -1.0 2.0
   43    38   -42    64   0.09800  1.0 3.0
   71    66    68    69   0.15000  1.0 3.0
   71    66    68    70   0.15000  1.0 3.0
   71    66    68    43   0.56750  1.0 1.0
   71    66    68    43  -0.07550 -1.0 2.0
   71    66    68    43   0.20000  1.0 3.0
   57    53    54    55   0.34800  1.0 3.0
   57    53    54    56   0.34800  1.0 3.0
   57    53    54    61   0.46850  1.0 1.0
   57    53    54    61   0.08550 -1.0 2.0
   57    53    54    61   0.09800  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    42   0.34400  1.0 1.0
   40    33    38    42   0.09450 -1.0 2.0
   40    33    38    42   0.11100  1.0 3.0
   40    33    38    43   0.56750  1.0 1.0
   40    33    38    43  -0.07550 -1.0 2.0
   40    33    38    43   0.20000  1.0 3.0
   41    40    46    47   0.00000  1.0 1.0
   41    40    46    48   0.00000  1.0 1.0
   41    40    49    50   0.15000  1.0 3.0
   41    40    49    51   0.15000  1.0 3.0
   41    40    49    52   0.15000  1.0 3.0
   46    40    49    50  -0.11250  1.0 3.0
   46    40    49    51  -0.11250  1.0 3.0
   46    40    49    52  -0.11250  1.0 3.0
   49    40    46    47   0.41150 -1.0 2.0
   49    40    46    48   0.41150 -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
   38    64    42    53   1.10000 -1.0 2.0
   54    57    53    42   1.10000 -1.0 2.0
   47    40    46    48  10.50000 -1.0 2.0
END
