* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    112    173     337
    1     0 S   NP   _N1_     1    29.66714    95.16043   -18.25237
    2     1 S   H    _HN1     2     1.02850    85.83082     3.41524
    3     1 S   H    _H1_     3     1.02996    54.92616   117.84179
    4     1 S   H    _H2_     4     1.02819    67.35771  -108.23113
    5     1 S   CT   _CA1     5     1.50295   160.81383   159.57283
    6     5 S   HC   _HA1     6     1.09661   104.85321    28.14420
    7     5 S   CO3  _C1_     7     1.54636   111.33919   -88.46396
    8     7 S   O2Z  _O11     8     1.26251   116.58542  -121.89788
    9     7 S   O2Z  _O12     9     1.26451   113.95735    57.36050
   10     5 S   CT   _CB1    10     1.53155   107.38397   144.89646
   11    10 S   HC   HB11    11     1.09802   110.56934   -41.91289
   12    10 S   HC   HB12    12     1.09738   109.48910    74.47933
   13    10 S   CT   _CG1    13     1.53172   111.88417  -162.34206
   14    13 S   HC   HG11    14     1.09568   111.22737   -39.37952
   15    13 S   HC   HG12    15     1.09671   109.56501    78.96626
   16    13 S   C    _CD1    16     1.51683   112.82616  -160.03394
   17    16 S   O    _OE1    17     1.22694   123.46962    -2.36538
   18    16 S   N    _N2_    18     1.38468   111.41801   176.55292
   19    18 S   H    _HN2    19     1.01633   118.93650     1.84164
   20    18 S   CT1  _CA2    20     1.46027   123.59102   178.76409
   21    20 S   HC   _HA2    21     1.09737   109.32771   -14.76508
   22    20 S   C    _C2_    22     1.53542   107.91964  -129.94656
   23    22 S   O    _O2_    23     1.22998   122.50812  -147.86615
   24    20 S   CT   _CB2    32     1.53338   111.60880   107.76129
   25    24 S   HC   HB21    33     1.09312   110.35018    51.75285
   26    24 S   HC   HB22    34     1.09531   110.01265   169.39156
   27    22 S   N    _N3_    24     1.38393   113.36624    39.55171
   28    27 S   H    _HN3    25     1.01636   119.54103    -3.13538
   29    24 S   S    _SG2    35     1.83031   112.53669   -73.11817
   30    27 S   CT   _CA3    26     1.45302   123.16941   177.17513
   31    30 S   HC   HA31    27     1.09548   107.45245   -65.85347
   32    30 S   HC   HA32    28     1.09555   108.05939    50.60529
   33    29 S   CT   _C7_    36     1.85255   101.69256   104.69151
   34    33 S   HC   _H6_    37     1.09654   108.01247   -35.95370
   35    30 S   CO3  _C3_    29     1.52949   114.04734   172.59771
   36    35 S   O2Z  _O31    30     1.26379   116.00936    -2.26900
   37    35 S   O2Z  _O32    31     1.26422   114.43250   177.81779
   38    33 S   CT   _C6_    38     1.54334   107.80190  -154.85820
   39    38 S   HC   _H5_    39     1.09780   111.19680   -49.38501
   40    38 S   CT   _C5_    40     1.53546   113.12620  -173.12072
   41    40 S   HC   _H4_    41     1.09679   110.00404   -67.96445
   42    38 S   NP   _N4_    58     1.49623   109.85659    66.62418
   43    42 S   H    _H11    59     1.03026   111.97768   -50.46031
   44    42 S   H    _H12    60     1.02900   111.11404  -170.73079
   45    42 S   H    _H13    61     1.03416   112.12075    70.76110
   46    40 S   CT   _C4_    42     1.52761   111.22830    53.69794
   47    46 S   HC   _H3_    43     1.09644   111.46682    71.25136
   48    40 S   OH   _O35    56     1.42986   109.52201   174.44741
   49    48 S   HO   _H14    57     0.97326   108.86894   -59.92240
   50    46 S   CT   _C9_    44     1.52623   112.05594   -54.23100
   51    50 S   HC   _H8_    45     1.09728   110.53515   -67.32986
   52    46 S   NP   _N5_    52     1.49699   108.53727  -174.10452
   53    52 S   H    _H15    53     1.02951   111.22386   -59.49512
   54    52 S   H    _H16    54     1.02970   110.98518  -179.24463
   55    52 S   H    _H17    55     1.02933   112.29339    60.71088
   56    33 S   CT   _C8_    46     1.54488   110.10745    84.45146
   57    56 S   HC   _H7_    47     1.09753   110.36276    49.93592
   58    50 S   OH   _O33    50     1.43007   108.82309   176.29932
   59    58 S   HO   _H9_    51     0.97296   108.70954   -77.01419
   60    56 S   OH   _O34    48     1.42776   110.86420   -67.75166
   61    60 S   HO   _H10    49     0.97252   108.57352   -65.84822
  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
  18   8   2   1   1  16   9  17   7   6   2   1   1  14   9   3
   1  11   6   5   2   1   1   5   3   2   1   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    56    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    50    56    57    60    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    46    50    51    56    57    60    61    58    48    42    43    44    45  
   38    39    40    50    56    57    60    42  
   36    37  
   37  
    0  
   39    40    41    46    47    50    56    57    60    52    48    49    42    43    44    45  
   40    41    46    56    48    42    43    44    45  
   41    46    47    50    51    56    58    52    53    54    55    48    49    42    43    44    45  
   46    47    50    52    48    49    42  
   43    44    45    46    48    56  
   44    45  
   45  
    0  
   47    50    51    56    57    60    58    59    52    53    54    55    48    49  
   50    51    56    58    52    53    54    55    48  
   49    50    52  
    0  
   51    56    57    60    61    58    59    52    53    54    55  
   56    57    60    58    59    52  
   53    54    55    56    58  
   54    55  
   55  
    0  
   57    60    61    58    59  
   60    61    58  
   59    60  
    0  
   61  
    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   1.6450   1.4500   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   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   43   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   44   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   45   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   53   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   54   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   55   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    56   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   367.000  1.471
   40    41   340.000  1.090
   40    46   268.000  1.529
   40    48   320.000  1.410
   46    47   340.000  1.090
   46    50   268.000  1.529
   46    52   367.000  1.471
   50    51   340.000  1.090
   50    56   268.000  1.529
   50    58   320.000  1.410
   56    57   340.000  1.090
   56    60   320.000  1.410
   60    61   553.000  0.945
   58    59   553.000  0.945
   52    53   434.000  1.010
   52    54   434.000  1.010
   52    55   434.000  1.010
   48    49   553.000  0.945
   42    43   434.000  1.010
   42    44   434.000  1.010
   42    45   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    56    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    80.00000  111.20000
   33    56    50    58.35000  112.70000
   33    56    57    37.50000  110.70000
   33    56    60    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    46    58.35000  112.70000
   38    40    48    50.00000  109.50000
   38    42    43    35.00000  109.50000
   38    42    44    35.00000  109.50000
   38    42    45    35.00000  109.50000
   40    38    39    37.50000  110.70000
   40    46    47    37.50000  110.70000
   40    46    50    58.35000  112.70000
   40    46    52    80.00000  111.20000
   40    48    49    55.00000  108.50000
   46    40    41    37.50000  110.70000
   46    50    51    37.50000  110.70000
   46    50    56    58.35000  112.70000
   46    50    58    50.00000  109.50000
   46    52    53    35.00000  109.50000
   46    52    54    35.00000  109.50000
   46    52    55    35.00000  109.50000
   50    46    47    37.50000  110.70000
   50    56    57    37.50000  110.70000
   50    56    60    50.00000  109.50000
   50    58    59    55.00000  108.50000
   56    33    34    37.50000  110.70000
   56    33    38    58.35000  112.70000
   56    50    51    37.50000  110.70000
   56    60    61    55.00000  108.50000
   60    56    57    35.00000  109.50000
   58    50    51    35.00000  109.50000
   58    50    56    50.00000  109.50000
   52    46    47    35.00000  109.50000
   52    46    50    80.00000  111.20000
   54    52    53    35.00000  109.50000
   55    52    53    35.00000  109.50000
   55    52    54    35.00000  109.50000
   48    40    41    35.00000  109.50000
   48    40    46    50.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    80.00000  111.20000
   44    42    43    35.00000  109.50000
   45    42    43    35.00000  109.50000
   45    42    44    35.00000  109.50000
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    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   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    56    50   0.44750  1.0 1.0
   29    33    56    50  -0.17800 -1.0 2.0
   29    33    56    50   0.20200  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    60   0.56750  1.0 1.0
   29    33    56    60  -0.07550 -1.0 2.0
   29    33    56    60   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    46   0.56750  1.0 1.0
   33    38    40    46  -0.07550 -1.0 2.0
   33    38    40    46   0.20000  1.0 3.0
   33    38    40    48   0.86500  1.0 1.0
   33    38    40    48  -0.17500 -1.0 2.0
   33    38    40    48   0.20800  1.0 3.0
   33    38    42    43   0.17350  1.0 3.0
   33    38    42    44   0.17350  1.0 3.0
   33    38    42    45   0.17350  1.0 3.0
   33    56    60    61  -0.11600  1.0 1.0
   33    56    60    61  -0.09450 -1.0 2.0
   33    56    60    61   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   0.19200  1.0 3.0
   34    33    56    50   0.15000  1.0 3.0
   34    33    56    57   0.15000  1.0 3.0
   34    33    56    60   0.23400  1.0 3.0
   38    33    56    50   0.56750  1.0 1.0
   38    33    56    50  -0.07550 -1.0 2.0
   38    33    56    50   0.20000  1.0 3.0
   38    33    56    57   0.15000  1.0 3.0
   38    33    56    60   0.86500  1.0 1.0
   38    33    56    60  -0.17500 -1.0 2.0
   38    33    56    60   0.20800  1.0 3.0
   38    40    46    47   0.15000  1.0 3.0
   38    40   -46    50   0.56750  1.0 1.0
   38    40   -46    50  -0.07550 -1.0 2.0
   38    40   -46    50   0.20000  1.0 3.0
   38    40    46    52   1.36600  1.0 1.0
   38    40    46    52  -0.11450 -1.0 2.0
   38    40    46    52   0.24250  1.0 3.0
   38    40    48    49  -0.11600  1.0 1.0
   38    40    48    49  -0.09450 -1.0 2.0
   38    40    48    49   0.21250  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    46   0.15000  1.0 3.0
   39    38    40    48   0.23400  1.0 3.0
   39    38    42    43   0.13050  1.0 3.0
   39    38    42    44   0.13050  1.0 3.0
   39    38    42    45   0.13050  1.0 3.0
   40    38    42    43   0.17350  1.0 3.0
   40    38    42    44   0.17350  1.0 3.0
   40    38    42    45   0.17350  1.0 3.0
   40    46    50    51   0.15000  1.0 3.0
   40    46    50    56   0.56750  1.0 1.0
   40    46    50    56  -0.07550 -1.0 2.0
   40    46    50    56   0.20000  1.0 3.0
   40    46    50    58   0.86500  1.0 1.0
   40    46    50    58  -0.17500 -1.0 2.0
   40    46    50    58   0.20800  1.0 3.0
   40    46    52    53   0.17350  1.0 3.0
   40    46    52    54   0.17350  1.0 3.0
   40    46    52    55   0.17350  1.0 3.0
   41    40    46    47   0.15000  1.0 3.0
   41    40    46    50   0.15000  1.0 3.0
   41    40    46    52   0.19200  1.0 3.0
   41    40    48    49   0.19450  1.0 3.0
   46    40    48    49  -0.11600  1.0 1.0
   46    40    48    49  -0.09450 -1.0 2.0
   46    40    48    49   0.21250  1.0 3.0
   46    50   -56    33   0.56750  1.0 1.0
   46    50   -56    33  -0.07550 -1.0 2.0
   46    50   -56    33   0.20000  1.0 3.0
   46    50    56    57   0.15000  1.0 3.0
   46    50    56    60   0.86500  1.0 1.0
   46    50    56    60  -0.17500 -1.0 2.0
   46    50    56    60   0.20800  1.0 3.0
   46    50    58    59  -0.11600  1.0 1.0
   46    50    58    59  -0.09450 -1.0 2.0
   46    50    58    59   0.21250  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    56   0.15000  1.0 3.0
   47    46    50    58   0.23400  1.0 3.0
   47    46    52    53   0.13050  1.0 3.0
   47    46    52    54   0.13050  1.0 3.0
   47    46    52    55   0.13050  1.0 3.0
   50    46    52    53   0.17350  1.0 3.0
   50    46    52    54   0.17350  1.0 3.0
   50    46    52    55   0.17350  1.0 3.0
   50    56    60    61  -0.11600  1.0 1.0
   50    56    60    61  -0.09450 -1.0 2.0
   50    56    60    61   0.21250  1.0 3.0
   51    50    56    33   0.15000  1.0 3.0
   51    50    56    57   0.15000  1.0 3.0
   51    50    56    60   0.23400  1.0 3.0
   51    50    58    59   0.19450  1.0 3.0
   56    33    38    39   0.15000  1.0 3.0
   56    33   -38    40   0.56750  1.0 1.0
   56    33   -38    40  -0.07550 -1.0 2.0
   56    33   -38    40   0.20000  1.0 3.0
   56    33    38    42   1.36600  1.0 1.0
   56    33    38    42  -0.11450 -1.0 2.0
   56    33    38    42   0.24250  1.0 3.0
   56    50    58    59  -0.11600  1.0 1.0
   56    50    58    59  -0.09450 -1.0 2.0
   56    50    58    59   0.21250  1.0 3.0
   57    56    60    61   0.19450  1.0 3.0
   58    50    56    33   0.86500  1.0 1.0
   58    50    56    33  -0.17500 -1.0 2.0
   58    50    56    33   0.20800  1.0 3.0
   58    50    56    57   0.23400  1.0 3.0
   58    50    56    60   3.75450  1.0 1.0
   52    46    50    51   0.19200  1.0 3.0
   52    46    50    56   1.36600  1.0 1.0
   52    46    50    56  -0.11450 -1.0 2.0
   52    46    50    56   0.24250  1.0 3.0
   52    46    50    58   1.69300  1.0 1.0
   52    46    50    58  -0.48450 -1.0 2.0
   48    40    46    47   0.23400  1.0 3.0
   48    40    46    50   0.86500  1.0 1.0
   48    40    46    50  -0.17500 -1.0 2.0
   48    40    46    50   0.20800  1.0 3.0
   48    40    46    52   1.69300  1.0 1.0
   48    40    46    52  -0.48450 -1.0 2.0
   42    38    40    41   0.19200  1.0 3.0
   42    38    40    46   1.36600  1.0 1.0
   42    38    40    46  -0.11450 -1.0 2.0
   42    38    40    46   0.24250  1.0 3.0
   42    38    40    48   1.69300  1.0 1.0
   42    38    40    48  -0.48450 -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
END
