* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    128    199     379
    1     0 S   NP   _N1_     1    28.50610    96.95111   -21.78702
    2     1 S   H    _HN1     2     1.02784    94.19634   -94.58420
    3     1 S   H    _H1_     3     1.02951    73.05810    13.32766
    4     1 S   H    _H2_     4     1.02829    43.37614   153.66215
    5     1 S   CT   _CA1     5     1.50105   149.48646   114.94112
    6     5 S   HC   _HA1     6     1.09573   105.22050    86.59445
    7     5 S   CO3  _C1_     7     1.53796   112.39816   -33.66835
    8     7 S   O2Z  _O11     8     1.26370   115.01298   -44.20940
    9     7 S   O2Z  _O12     9     1.26237   114.94314   134.94092
   10     5 S   CT   _CB1    10     1.53086   107.42353  -155.44239
   11    10 S   HC   HB11    11     1.09830   109.40371   -50.01650
   12    10 S   HC   HB12    12     1.09814   110.43838    66.59098
   13    10 S   CT   _CG1    13     1.52984   112.58571  -171.01036
   14    13 S   HC   HG11    14     1.09589   110.58233   -64.41620
   15    13 S   HC   HG12    15     1.09667   109.84018    54.80535
   16    13 S   C    _CD1    16     1.51801   112.27470   175.25831
   17    16 S   O    _OE1    17     1.22729   123.30015     4.25082
   18    16 S   N    _N2_    18     1.38631   111.61687  -175.85131
   19    18 S   H    _HN2    19     1.01594   118.99616     1.78838
   20    18 S   CT1  _CA2    20     1.46221   123.45901   178.29303
   21    20 S   HC   _HA2    21     1.09741   109.32049     1.13229
   22    20 S   C    _C2_    22     1.53548   108.92788  -114.35149
   23    22 S   O    _O2_    23     1.23059   122.25523  -150.76993
   24    20 S   CT   _CB2    32     1.53330   111.36756   123.05038
   25    24 S   HC   HB21    33     1.09458   109.76783    55.24872
   26    24 S   HC   HB22    34     1.09504   110.25494   174.55785
   27    22 S   N    _N3_    24     1.38326   113.76558    36.84859
   28    27 S   H    _HN3    25     1.01584   119.54190    -3.62299
   29    24 S   S    _SG2    35     1.82719   111.29725   -65.66805
   30    27 S   CT   _CA3    26     1.45272   123.17619   177.01568
   31    30 S   HC   HA31    27     1.09550   107.53086   -64.12581
   32    30 S   HC   HA32    28     1.09558   107.96018    52.30165
   33    29 S   CT   _C8_    36     1.85216    99.68565  -176.94463
   34    33 S   HC   _H3_    37     1.09446   106.95811    40.23392
   35    30 S   CO3  _C3_    29     1.52943   114.10334   174.29752
   36    35 S   O2Z  _O31    30     1.26375   116.07907    -0.18557
   37    35 S   O2Z  _O32    31     1.26432   114.40881   179.86878
   38    33 S   CM   _C6_    38     1.52266   109.75148   -80.17086
   39    38 S   CT   _C5_    39     1.50939   111.98614   -75.59788
   40    39 S   HC   _H10    40     1.09638   109.73338    61.21477
   41    39 S   HC   _H11    41     1.09297   113.85082   179.07762
   42    38 S   CMA  _C7_    66     1.35815   122.64206   108.49375
   43    42 S   OM   _O33    67     1.25873   129.92119    -1.24065
   44    39 S   CT   _C4_    42     1.51936   108.87616   -59.05346
   45    44 S   HC   _H8_    43     1.09780   109.89333   -81.90410
   46    44 S   HC   _H9_    44     1.09616   109.83029   161.55136
   47    42 S   NE   _N4_    68     1.36624   122.70628   178.33505
   48    47 S   H    _H12    69     1.00823   122.51023     1.65031
   49    47 S   H    _H13    70     1.01203   117.28957   179.63309
   50    44 S   CG   _C9_    45     1.50215   116.12370    38.94287
   51    50 S   HC   _H14    46     1.10095   118.79822   171.18954
   52    33 S   N*   _N5_    47     1.51549   114.55135   155.81462
   53    52 S   CO   _C10    48     1.51045   116.76677   -80.80050
   54    53 S   HC   _H4_    49     1.09738   106.59076   147.86249
   55    53 S   CT   _C11    50     1.53141   108.81657   -92.18636
   56    55 S   HC   _H5_    51     1.09769   111.40790    38.92841
   57    55 S   CT   _C12    52     1.51796   102.07370   155.78034
   58    57 S   HC   _H6_    53     1.09388   112.92851  -161.52222
   59    55 S   OH   _O37    64     1.41585   112.10799   -82.75544
   60    59 S   HO   _H19    65     0.97278   107.59779  -166.45443
   61    57 S   CT   _C13    54     1.52301   100.52753   -39.86807
   62    61 S   HC   _H7_    55     1.09762   110.32056   -75.45096
   63    57 S   OH   _O36    62     1.42456   109.63534    77.43017
   64    63 S   HO   _H18    63     0.97251   107.78798   173.10462
   65    53 S   OS   _O34    56     1.44466   117.67618    28.40194
   66    61 S   CT   _C14    57     1.52102   115.47983   158.85846
   67    66 S   HC   _H15    58     1.09415   110.92436    51.80644
   68    66 S   HC   _H16    59     1.09460   111.47093   -70.87461
   69    66 S   OH   _O35    60     1.42438   108.87399   170.53558
   70    69 S   HO   _H17    61     0.97243   107.13159   178.67278
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  16   6   2   1   1  14  11   6   5   6   3   6   4   3   2   1
   1   6   2   8  12   6  11   7  12   7   4   1   9   6   3   1
   4   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    52    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    50    52    53    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    50    51    52    53    54    55    65    42    43    47  
   38    39    50    52    53    42  
   36    37  
   37  
    0  
   39    40    41    44    45    46    50    52    53    42    43    47    48    49  
   40    41    44    45    46    50    51    52    42    43    47  
   41    44    45    46    50    42  
   44    45    46    50    42  
   43    47    48    49    44    52  
   47    48    49  
   45    46    50    51    52    53  
   46    50    51    52  
   50    51    52  
   48    49  
   49  
    0  
   51    52    53    54    55    65  
   52    53  
   53    54    55    56    57    61    65    59  
   54    55    56    57    58    61    62    65    66    63    59    60  
   55    56    57    61    65    59  
   56    57    58    61    62    65    66    63    64    59    60  
   57    58    61    65    63    59    60  
   58    61    62    65    66    67    68    69    63    64    59    60  
   61    62    65    66    63    64    59  
   60    61    63    65  
    0  
   62    65    66    67    68    69    70    63    64  
   65    66    67    68    69    63  
   64    65    66  
    0  
   66    67    68    69  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.514200   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660   0.215700   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.2500   0.1700  -1.229900   1.8650   1.6500   0.051222218  -2.220205820
   48   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   49   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7500   0.1050  -0.072300   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.273100   1.4250   1.2500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.065700   1.9050   1.6860   0.051222218  -2.220205820
   53   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0150   0.100000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   66   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.1200   0.1700  -0.655000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.0000   0.0000   0.390000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    52   337.000  1.475
   38    39   317.000  1.510
   38    42   465.000  1.376
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    50   290.000  1.488
   50    51   385.000  1.083
   50    52   590.000  1.308
   52    53   275.000  1.479
   53    54   340.000  1.090
   53    55   250.000  1.527
   53    65   320.000  1.380
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    59   320.000  1.410
   57    58   340.000  1.090
   57    61   268.000  1.529
   57    63   320.000  1.410
   61    62   340.000  1.090
   61    65   320.000  1.410
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   320.000  1.410
   69    70   553.000  0.945
   63    64   553.000  0.945
   59    60   553.000  0.945
   42    43   745.000  1.250
   42    47   415.000  1.382
   47    48   434.000  1.010
   47    49   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  112.20000
   29    33    52    80.00000  108.62000
   33    38    39    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    52    50    85.00000  113.64000
   33    52    53    65.00000  120.78000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    41    35.00000  109.50000
   38    39    44    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    47    75.00000  114.40000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    50    70.00000  109.02000
   41    39    40    33.00000  107.80000
   44    39    40    37.50000  110.70000
   44    39    41    37.50000  110.70000
   44    50    51    35.00000  121.91500
   44    50    52    65.00000  114.34000
   46    44    45    33.00000  107.80000
   50    44    45    45.00000  109.33400
   50    44    46    45.00000  109.33400
   50    52    53    65.00000  122.98000
   52    33    34    35.00000  109.50000
   52    33    38    80.00000  111.76000
   52    50    51    45.00000  115.58000
   52    53    54    55.00000  103.44000
   52    53    55    75.00000  107.44000
   52    53    65   105.00000  106.22000
   53    55    56    45.00000  108.72000
   53    55    57    75.00000  109.43000
   53    55    59    90.00000  111.58700
   53    65    61    60.00000  109.50000
   55    53    54    45.00000  112.01100
   55    57    58    37.50000  110.70000
   55    57    61    58.35000  112.70000
   55    57    63    50.00000  109.50000
   55    59    60    55.00000  108.50000
   57    55    56    37.50000  110.70000
   57    61    62    37.50000  110.70000
   57    61    65    50.00000  109.50000
   57    61    66    58.35000  112.70000
   57    63    64    55.00000  108.50000
   61    57    58    37.50000  110.70000
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    69    50.00000  109.50000
   65    53    54    35.00000  109.50000
   65    53    55    90.00000  108.56700
   65    61    62    35.00000  109.50000
   66    61    62    37.50000  110.70000
   66    61    65    50.00000  109.50000
   66    69    70    55.00000  108.50000
   68    66    67    33.00000  107.80000
   69    66    67    35.00000  109.50000
   69    66    68    35.00000  109.50000
   63    57    58    35.00000  109.50000
   63    57    61    50.00000  109.50000
   59    55    56    35.00000  109.50000
   59    55    57    50.00000  109.50000
   42    38    39    70.00000  124.00000
   42    47    48    50.00000  121.48000
   42    47    49    50.00000  121.48000
   47    42    43   105.00000  113.92000
   49    47    48    35.00000  109.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   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   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    52    50   0.68100  1.0 1.0
   29    33    52    50   0.03350 -1.0 2.0
   29    33    52    50   0.36200  1.0 3.0
   29    33    52    53   0.68100  1.0 1.0
   29    33    52    53   0.03350 -1.0 2.0
   29    33    52    53   0.36200  1.0 3.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    41   0.34800  1.0 3.0
   33    38    39    44   0.46850  1.0 1.0
   33    38    39    44   0.08550 -1.0 2.0
   33    38    39    44   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    47   7.00000 -1.0 2.0
   33    52    53    54   0.00000  1.0 1.0
   33    52    53    55   2.08450  1.0 1.0
   33    52    53    55  -0.39300 -1.0 2.0
   33    52    53    55   0.23400  1.0 3.0
   33    52    53    65   0.10350  1.0 1.0
   33    52    53    65  -0.15350 -1.0 2.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    52    50   0.00000  1.0 1.0
   34    33    52    53   0.00000  1.0 1.0
   38    33    52    50   0.68100  1.0 1.0
   38    33    52    50   0.03350 -1.0 2.0
   38    33    52    50   0.36200  1.0 3.0
   38    33    52    53   0.68100  1.0 1.0
   38    33    52    53   0.03350 -1.0 2.0
   38    33    52    53   0.36200  1.0 3.0
   38    39    44    45   0.15000  1.0 3.0
   38    39    44    46   0.15000  1.0 3.0
   38    39   -44    50   0.31000  1.0 1.0
   38    39   -44    50   0.14700 -1.0 2.0
   38    39   -44    50   0.07550  1.0 3.0
   38    42    47    48   1.00000 -1.0 2.0
   38    42    47    49   1.00000 -1.0 2.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    47   7.00000 -1.0 2.0
   39    44    50    51   0.00000  1.0 1.0
   39    44    50    52  -0.93550  1.0 1.0
   39    44    50    52   0.38900 -1.0 2.0
   39    44    50    52   0.16950  1.0 3.0
   40    39    44    45   0.15000  1.0 3.0
   40    39    44    46   0.15000  1.0 3.0
   40    39    44    50   0.15000  1.0 3.0
   41    39    44    45   0.15000  1.0 3.0
   41    39    44    46   0.15000  1.0 3.0
   41    39    44    50   0.15000  1.0 3.0
   44    50   -52    33   3.62500 -1.0 2.0
   44    50    52    53   3.62500 -1.0 2.0
   45    44    50    51   0.33100  1.0 3.0
   45    44    50    52   0.00000  1.0 1.0
   46    44    50    51   0.33100  1.0 3.0
   46    44    50    52   0.00000  1.0 1.0
   50    52    53    54   0.00000  1.0 1.0
   50    52    53    55   2.08450  1.0 1.0
   50    52    53    55  -0.39300 -1.0 2.0
   50    52    53    55   0.23400  1.0 3.0
   50    52    53    65  -0.28000  1.0 1.0
   50    52    53    65  -1.16550 -1.0 2.0
   51    50    52    33   1.88100 -1.0 2.0
   51    50    52    53   1.88100 -1.0 2.0
   52    33   -38    39   0.09700  1.0 1.0
   52    33   -38    39   0.15600 -1.0 2.0
   52    33   -38    39  -0.50800  1.0 3.0
   52    33    38    42   0.62150  1.0 1.0
   52    33    38    42   0.42850 -1.0 2.0
   52    33    38    42  -0.68200  1.0 3.0
   52    53    55    56   0.15000  1.0 3.0
   52    53    55    57  -0.27100  1.0 1.0
   52    53    55    57  -0.01700 -1.0 2.0
   52    53    55    57  -0.48600  1.0 3.0
   52    53    55    59   2.76900  1.0 1.0
   52    53    55    59  -0.24350 -1.0 2.0
   52    53    55    59  -0.78250  1.0 3.0
   52    53    65    61  -2.37750  1.0 1.0
   52    53    65    61  -0.08150 -1.0 2.0
   52    53    65    61   0.59000  1.0 3.0
   53    55    57    58   0.15000  1.0 3.0
   53    55   -57    61   3.97050  1.0 1.0
   53    55    57    63   0.86500  1.0 1.0
   53    55    57    63  -0.17500 -1.0 2.0
   53    55    57    63   0.20800  1.0 3.0
   53    55    59    60  -0.11600  1.0 1.0
   53    55    59    60  -0.09450 -1.0 2.0
   53    55    59    60   0.21250  1.0 3.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    59   0.23400  1.0 3.0
   54    53    65    61   0.37050  1.0 3.0
   55    53   -65    61   0.06250  1.0 1.0
   55    53   -65    61  -0.01100 -1.0 2.0
   55    53   -65    61   0.28050  1.0 3.0
   55    57    61    62   0.15000  1.0 3.0
   55    57   -61    65   0.62750  1.0 1.0
   55    57   -61    65  -0.30950 -1.0 2.0
   55    57   -61    65   0.27300  1.0 3.0
   55    57    61    66   0.56750  1.0 1.0
   55    57    61    66  -0.07550 -1.0 2.0
   55    57    61    66   0.20000  1.0 3.0
   55    57    63    64  -0.11600  1.0 1.0
   55    57    63    64  -0.09450 -1.0 2.0
   55    57    63    64   0.21250  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55    57    61   0.15000  1.0 3.0
   56    55    57    63   0.23400  1.0 3.0
   56    55    59    60   0.19450  1.0 3.0
   57    55    59    60  -0.11600  1.0 1.0
   57    55    59    60  -0.09450 -1.0 2.0
   57    55    59    60   0.21250  1.0 3.0
   57    61   -65    53   0.06250  1.0 1.0
   57    61   -65    53  -0.01100 -1.0 2.0
   57    61   -65    53   0.28050  1.0 3.0
   57    61    66    67   0.15000  1.0 3.0
   57    61    66    68   0.15000  1.0 3.0
   57    61    66    69   0.86500  1.0 1.0
   57    61    66    69  -0.17500 -1.0 2.0
   57    61    66    69   0.20800  1.0 3.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    65   0.23400  1.0 3.0
   58    57    61    66   0.15000  1.0 3.0
   58    57    63    64   0.19450  1.0 3.0
   61    57    63    64  -0.11600  1.0 1.0
   61    57    63    64  -0.09450 -1.0 2.0
   61    57    63    64   0.21250  1.0 3.0
   61    66    69    70  -0.11600  1.0 1.0
   61    66    69    70  -0.09450 -1.0 2.0
   61    66    69    70   0.21250  1.0 3.0
   62    61    65    53   0.37050  1.0 3.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    68   0.15000  1.0 3.0
   62    61    66    69   0.23400  1.0 3.0
   65    53    55    56   0.23400  1.0 3.0
   65    53   -55    57   0.62750  1.0 1.0
   65    53   -55    57  -0.30950 -1.0 2.0
   65    53   -55    57   0.27300  1.0 3.0
   65    53    55    59   3.69350  1.0 1.0
   65    53    55    59  -1.82950 -1.0 2.0
   65    61    66    67   0.23400  1.0 3.0
   65    61    66    68   0.23400  1.0 3.0
   65    61    66    69   3.69350  1.0 1.0
   65    61    66    69  -1.82950 -1.0 2.0
   66    61    65    53   0.06250  1.0 1.0
   66    61    65    53  -0.01100 -1.0 2.0
   66    61    65    53   0.28050  1.0 3.0
   67    66    69    70   0.19450  1.0 3.0
   68    66    69    70   0.19450  1.0 3.0
   63    57    61    62   0.23400  1.0 3.0
   63    57    61    65   3.69350  1.0 1.0
   63    57    61    65  -1.82950 -1.0 2.0
   63    57    61    66   0.86500  1.0 1.0
   63    57    61    66  -0.17500 -1.0 2.0
   63    57    61    66   0.20800  1.0 3.0
   59    55    57    58   0.23400  1.0 3.0
   59    55    57    61   0.86500  1.0 1.0
   59    55    57    61  -0.17500 -1.0 2.0
   59    55    57    61   0.20800  1.0 3.0
   59    55    57    63   3.75450  1.0 1.0
   42    38    39    40   0.00000  1.0 1.0
   42    38    39    41   0.00000  1.0 1.0
   42    38    39    44   0.09850  1.0 1.0
   42    38    39    44   0.15250 -1.0 2.0
   42    38    39    44  -0.50650  1.0 3.0
   43    42    47    48   1.00000 -1.0 2.0
   43    42    47    49   1.00000 -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
   33    39    38    42   1.10000 -1.0 2.0
   44    51    50    52  10.50000 -1.0 2.0
   33    53    52    50   1.00000 -1.0 2.0
   47    43    42    38   1.10000 -1.0 2.0
   49    42    47    48   1.00000 -1.0 2.0
END
