* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    139    217     415
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02114    80.88891   -82.63273
    3     1 S   H    _H1_     3     1.02063    98.14448    25.11209
    4     1 S   H    _H2_     4     1.02080    35.57899   136.01226
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08611   110.49349    58.84143
   26    24 S   HC   HB22    34     1.08640   109.89279   178.97703
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   S    _S2_    36     2.05039   101.83417   179.98022
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C9_    37     1.83699   100.96923    90.03160
   38    37 S   HC   _H6_    38     1.09910   105.87117   -37.34395
   39    37 S   CT   _C8_    39     1.51772   108.71309    79.95271
   40    39 S   HC   _H5_    40     1.09731   109.37053   -37.88247
   41    37 S   CT   _C10    66     1.54795   109.54649  -154.27237
   42    41 S   HC   _H7_    67     1.09786   109.32494  -162.34646
   43    39 S   CT   _C7_    41     1.52296   113.56751    84.89192
   44    43 S   HC   _H15    42     1.09679   111.30812    43.95215
   45    43 S   HC   _H16    43     1.09339   112.15918   -77.44352
   46    41 S   CT   _C11    68     1.53395   111.34854    76.28595
   47    46 S   HC   _H17    69     1.09453   110.92101   -80.00391
   48    46 S   HC   _H18    70     1.09426   111.10850    41.22475
   49    41 S   OH   _O33    73     1.42806   109.24372   -44.25963
   50    49 S   HO   _H20    74     0.96909   106.38364  -178.13449
   51    43 S   CT   _C6_    44     1.51559   102.62129   162.04319
   52    51 S   HC   _H13    45     1.09735   110.29282    74.49221
   53    51 S   HC   _H14    46     1.09359   112.20646  -165.07366
   54    46 S   SH   _S1_    71     1.82204   111.25863   160.17396
   55    54 S   HS   _H19    72     1.33916    95.80866   179.98022
   56    51 S   CT   _C5_    47     1.52297   102.82882   -44.45699
   57    56 S   HC   _H4_    48     1.09680   109.96854   -80.22302
   58    56 S   CT   _C12    49     1.52286   113.52674   154.64322
   59    58 S   HC   _H8_    50     1.09338   109.14455   -80.04247
   60    39 S   NP   _N4_    60     1.52971   114.69755  -155.57785
   61    60 S   H    _H3_    61     1.02927   105.89989   105.30402
   62    58 S   CT   _C13    51     1.53454   113.72391    42.19565
   63    62 S   HC   _H9_    52     1.09600   109.48306   -70.55633
   64    60 S   CT   _C4_    62     1.50152   117.78440   -12.96208
   65    64 S   HC   _H10    63     1.09200   107.79942   -61.74161
   66    64 S   HC   _H11    64     1.09240   107.83509    58.17335
   67    64 S   HC   _H12    65     1.09136   107.87111   178.26584
   68    62 S   CT   _C14    53     1.52806   109.97884   169.58773
   69    68 S   HC   _H21    54     1.09488   110.91097    71.38403
   70    68 S   HC   _H22    55     1.09476   111.85167  -166.81084
   71    62 S   OH   _O34    58     1.42625   111.36653    46.98574
   72    71 S   HO   _H23    59     0.96923   106.52447  -177.54872
   73    68 S   S    _S3_    56     1.81499   107.70476   -47.09647
   74    58 S   S    _S4_    57     1.82181   110.16339   162.30251
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   6   3   2   7   4   5   5   4   3
  10   2   1   1  19   8  20   9  10   6  11   6   5   6   4   3
   2   1  11   5   4   1   1  15   7  13   7   7   4   8   7   3
   2   1   1   6   4   3   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    43    60    41    42    46    49  
   35    36  
   36  
    0  
   38    39    40    43    44    45    51    56    60    61    64    41    42    46    47    48    54    49    50  
   39    40    43    60    41    42    46    49  
   40    43    44    45    51    52    53    56    57    58    60    61    64    65    66    67    41    42    46    49  
   43    44    45    51    56    60    61    64    41  
   42    46    47    48    54    55    49    50    43    60  
   46    47    48    54    49    50  
   44    45    51    52    53    56    57    58    60    61    64  
   45    51    52    53    56    60  
   51    52    53    56    60  
   47    48    54    55    49    50  
   48    54    55    49  
   54    55    49  
   50    54  
    0  
   52    53    56    57    58    59    62    74    60    61    64  
   53    56    57    58    60  
   56    57    58    60  
   55  
    0  
   57    58    59    62    63    68    73    74    71    60    61    64    65    66    67  
   58    59    62    74    60    61    64  
   59    62    63    68    69    70    73    74    71    72    60    61    64  
   62    63    68    73    74    71    60  
   61    64    65    66    67    62    74  
   64    65    66    67  
   63    68    69    70    73    74    71    72  
   68    69    70    73    74    71    72  
   65    66    67  
   66    67  
   67  
    0  
   69    70    73    74    71    72  
   70    73    74    71  
   73    74    71  
   72    73    74  
    0  
   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   0.097500   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  -0.217500   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   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.157500   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   39   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   46   3.5000   0.0660   0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   54   3.6000   0.4250  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   55   0.5000   0.0300   0.155000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660   0.157500   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   61   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   3.5000   0.0660   0.097500   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
   74   3.6000   0.3550  -0.217500   2.0300   1.8000   0.025682759  -1.666211680
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   166.000  2.038
   33    37   222.000  1.810
   37    38   340.000  1.090
   37    39   268.000  1.529
   37    41   268.000  1.529
   39    40   340.000  1.090
   39    43   268.000  1.529
   39    60   367.000  1.471
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    60   367.000  1.471
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    74   222.000  1.810
   62    63   340.000  1.090
   62    68   268.000  1.529
   62    71   320.000  1.410
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    73   222.000  1.810
   73    74   166.000  2.038
   71    72   553.000  0.945
   60    61   434.000  1.010
   60    64   367.000  1.471
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   41    42   340.000  1.090
   41    46   268.000  1.529
   41    49   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    54   222.000  1.810
   54    55   274.000  1.336
   49    50   553.000  0.945
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    68.00000  103.70000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    68.00000  103.70000
   33    37    38    35.00000  109.50000
   33    37    39    75.00000  111.63000
   33    37    41    75.00000  111.63000
   37    39    40    37.50000  110.70000
   37    39    43    58.35000  112.70000
   37    39    60    80.00000  111.20000
   37    41    42    37.50000  110.70000
   37    41    46    58.35000  112.70000
   37    41    49    50.00000  109.50000
   39    37    38    37.50000  110.70000
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    51    58.35000  112.70000
   39    60    56    75.00000  113.01200
   39    60    61    35.00000  109.50000
   39    60    64    75.00000  113.01200
   43    39    40    37.50000  110.70000
   43    51    52    37.50000  110.70000
   43    51    53    37.50000  110.70000
   43    51    56    58.35000  112.70000
   45    43    44    33.00000  107.80000
   51    43    44    37.50000  110.70000
   51    43    45    37.50000  110.70000
   51    56    57    37.50000  110.70000
   51    56    58    58.35000  112.70000
   51    56    60    80.00000  111.20000
   53    51    52    33.00000  107.80000
   56    51    52    37.50000  110.70000
   56    51    53    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    62    58.35000  112.70000
   56    58    74    75.00000  111.63000
   56    60    61    35.00000  109.50000
   56    60    64    75.00000  113.01200
   58    56    57    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    68    58.35000  112.70000
   58    62    71    50.00000  109.50000
   58    74    73    68.00000  103.70000
   62    58    59    37.50000  110.70000
   62    68    69    37.50000  110.70000
   62    68    70    37.50000  110.70000
   62    68    73    75.00000  111.63000
   62    71    72    55.00000  108.50000
   68    62    63    37.50000  110.70000
   68    73    74    68.00000  103.70000
   70    68    69    33.00000  107.80000
   73    68    69    35.00000  109.50000
   73    68    70    35.00000  109.50000
   74    58    59    35.00000  109.50000
   74    58    62    75.00000  111.63000
   71    62    63    35.00000  109.50000
   71    62    68    50.00000  109.50000
   60    39    40    35.00000  109.50000
   60    39    43    80.00000  111.20000
   60    56    57    35.00000  109.50000
   60    56    58    80.00000  111.20000
   60    64    65    35.00000  109.50000
   60    64    66    35.00000  109.50000
   60    64    67    35.00000  109.50000
   64    60    61    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   41    37    38    37.50000  110.70000
   41    37    39    58.35000  112.70000
   41    46    47    37.50000  110.70000
   41    46    48    37.50000  110.70000
   41    46    54    50.00000  108.60000
   41    49    50    55.00000  108.50000
   46    41    42    37.50000  110.70000
   46    54    55    44.00000   96.00000
   48    46    47    33.00000  107.80000
   54    46    47    35.00000  109.50000
   54    46    48    35.00000  109.50000
   49    41    42    35.00000  109.50000
   49    41    46    50.00000  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   0.97050  1.0 1.0
   20    24    29    33  -0.41800 -1.0 2.0
   20    24    29    33   0.46750  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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -3.49700 -1.0 2.0
   24    29    33    37   0.74750  1.0 3.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   0.24000  1.0 3.0
   29    33    37    39   0.09450  1.0 1.0
   29    33    37    39  -0.17100 -1.0 2.0
   29    33    37    39   0.39100  1.0 3.0
   29    33    37    41   0.09450  1.0 1.0
   29    33    37    41  -0.17100 -1.0 2.0
   29    33    37    41   0.39100  1.0 3.0
   33    37    39    40   0.15000  1.0 3.0
   33    37    39    43   0.44750  1.0 1.0
   33    37    39    43  -0.17800 -1.0 2.0
   33    37    39    43   0.20200  1.0 3.0
   33    37    39    60   0.56750  1.0 1.0
   33    37    39    60  -0.07550 -1.0 2.0
   33    37    39    60   0.20000  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    46   0.44750  1.0 1.0
   33    37    41    46  -0.17800 -1.0 2.0
   33    37    41    46   0.20200  1.0 3.0
   33    37    41    49   0.56750  1.0 1.0
   33    37    41    49  -0.07550 -1.0 2.0
   33    37    41    49   0.20000  1.0 3.0
   37    39    43    44   0.15000  1.0 3.0
   37    39    43    45   0.15000  1.0 3.0
   37    39    43    51   0.56750  1.0 1.0
   37    39    43    51  -0.07550 -1.0 2.0
   37    39    43    51   0.20000  1.0 3.0
   37    39    60    56   0.47100  1.0 1.0
   37    39    60    61   0.17350  1.0 3.0
   37    39    60    64   0.47100  1.0 1.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    48   0.15000  1.0 3.0
   37    41    46    54   0.43650  1.0 1.0
   37    41    49    50  -0.11600  1.0 1.0
   37    41    49    50  -0.09450 -1.0 2.0
   37    41    49    50   0.21250  1.0 3.0
   38    37    39    40   0.15000  1.0 3.0
   38    37    39    43   0.15000  1.0 3.0
   38    37    39    60   0.19200  1.0 3.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    46   0.15000  1.0 3.0
   38    37    41    49   0.23400  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    46   0.56750  1.0 1.0
   39    37    41    46  -0.07550 -1.0 2.0
   39    37    41    46   0.20000  1.0 3.0
   39    37    41    49   0.86500  1.0 1.0
   39    37    41    49  -0.17500 -1.0 2.0
   39    37    41    49   0.20800  1.0 3.0
   39    43    51    52   0.15000  1.0 3.0
   39    43    51    53   0.15000  1.0 3.0
   39    43   -51    56   0.56750  1.0 1.0
   39    43   -51    56  -0.07550 -1.0 2.0
   39    43   -51    56   0.20000  1.0 3.0
   39    60    64    65   0.15000  1.0 3.0
   39    60    64    66   0.15000  1.0 3.0
   39    60    64    67   0.15000  1.0 3.0
   40    39    43    44   0.15000  1.0 3.0
   40    39    43    45   0.15000  1.0 3.0
   40    39    43    51   0.15000  1.0 3.0
   40    39    60    56   0.15000  1.0 3.0
   40    39    60    61   0.13050  1.0 3.0
   40    39    60    64   0.15000  1.0 3.0
   43    39   -60    56   0.47100  1.0 1.0
   43    39    60    61   0.17350  1.0 3.0
   43    39    60    64   0.47100  1.0 1.0
   43    51    56    57   0.15000  1.0 3.0
   43    51    56    58   0.56750  1.0 1.0
   43    51    56    58  -0.07550 -1.0 2.0
   43    51    56    58   0.20000  1.0 3.0
   43    51   -56    60   1.36600  1.0 1.0
   43    51   -56    60  -0.11450 -1.0 2.0
   43    51   -56    60   0.24250  1.0 3.0
   44    43    51    52   0.15000  1.0 3.0
   44    43    51    53   0.15000  1.0 3.0
   44    43    51    56   0.15000  1.0 3.0
   45    43    51    52   0.15000  1.0 3.0
   45    43    51    53   0.15000  1.0 3.0
   45    43    51    56   0.15000  1.0 3.0
   51    56    58    59   0.15000  1.0 3.0
   51    56    58    62   0.56750  1.0 1.0
   51    56    58    62  -0.07550 -1.0 2.0
   51    56    58    62   0.20000  1.0 3.0
   51    56    58    74   0.44750  1.0 1.0
   51    56    58    74  -0.17800 -1.0 2.0
   51    56    58    74   0.20200  1.0 3.0
   51    56   -60    39   0.47100  1.0 1.0
   51    56    60    61   0.17350  1.0 3.0
   51    56    60    64   0.47100  1.0 1.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   52    51    56    60   0.19200  1.0 3.0
   53    51    56    57   0.15000  1.0 3.0
   53    51    56    58   0.15000  1.0 3.0
   53    51    56    60   0.19200  1.0 3.0
   56    58    62    63   0.15000  1.0 3.0
   56    58    62    68   0.56750  1.0 1.0
   56    58    62    68  -0.07550 -1.0 2.0
   56    58    62    68   0.20000  1.0 3.0
   56    58    62    71   0.86500  1.0 1.0
   56    58    62    71  -0.17500 -1.0 2.0
   56    58    62    71   0.20800  1.0 3.0
   56    58    74    73   0.09450  1.0 1.0
   56    58    74    73  -0.17100 -1.0 2.0
   56    58    74    73   0.39100  1.0 3.0
   56    60    64    65   0.15000  1.0 3.0
   56    60    64    66   0.15000  1.0 3.0
   56    60    64    67   0.15000  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    62   0.15000  1.0 3.0
   57    56    58    74   0.15000  1.0 3.0
   57    56    60    39   0.15000  1.0 3.0
   57    56    60    61   0.13050  1.0 3.0
   57    56    60    64   0.15000  1.0 3.0
   58    56    60    39   0.47100  1.0 1.0
   58    56    60    61   0.17350  1.0 3.0
   58    56    60    64   0.47100  1.0 1.0
   58    62    68    69   0.15000  1.0 3.0
   58    62    68    70   0.15000  1.0 3.0
   58    62   -68    73   0.44750  1.0 1.0
   58    62   -68    73  -0.17800 -1.0 2.0
   58    62   -68    73   0.20200  1.0 3.0
   58    62    71    72  -0.11600  1.0 1.0
   58    62    71    72  -0.09450 -1.0 2.0
   58    62    71    72   0.21250  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    68   0.15000  1.0 3.0
   59    58    62    71   0.23400  1.0 3.0
   59    58    74    73   0.24000  1.0 3.0
   62    58   -74    73   0.09450  1.0 1.0
   62    58   -74    73  -0.17100 -1.0 2.0
   62    58   -74    73   0.39100  1.0 3.0
   62    68   -73    74   0.09450  1.0 1.0
   62    68   -73    74  -0.17100 -1.0 2.0
   62    68   -73    74   0.39100  1.0 3.0
   63    62    68    69   0.15000  1.0 3.0
   63    62    68    70   0.15000  1.0 3.0
   63    62    68    73   0.15000  1.0 3.0
   63    62    71    72   0.19450  1.0 3.0
   68    62    71    72  -0.11600  1.0 1.0
   68    62    71    72  -0.09450 -1.0 2.0
   68    62    71    72   0.21250  1.0 3.0
   68    73   -74    58  -3.49700 -1.0 2.0
   68    73   -74    58   0.74750  1.0 3.0
   69    68    73    74   0.24000  1.0 3.0
   70    68    73    74   0.24000  1.0 3.0
   74    58    62    63   0.15000  1.0 3.0
   74    58   -62    68   0.44750  1.0 1.0
   74    58   -62    68  -0.17800 -1.0 2.0
   74    58   -62    68   0.20200  1.0 3.0
   74    58    62    71   0.56750  1.0 1.0
   74    58    62    71  -0.07550 -1.0 2.0
   74    58    62    71   0.20000  1.0 3.0
   71    62    68    69   0.23400  1.0 3.0
   71    62    68    70   0.23400  1.0 3.0
   71    62    68    73   0.56750  1.0 1.0
   71    62    68    73  -0.07550 -1.0 2.0
   71    62    68    73   0.20000  1.0 3.0
   60    39    43    44   0.19200  1.0 3.0
   60    39    43    45   0.19200  1.0 3.0
   60    39   -43    51   1.36600  1.0 1.0
   60    39   -43    51  -0.11450 -1.0 2.0
   60    39   -43    51   0.24250  1.0 3.0
   60    56    58    59   0.19200  1.0 3.0
   60    56    58    62   1.36600  1.0 1.0
   60    56    58    62  -0.11450 -1.0 2.0
   60    56    58    62   0.24250  1.0 3.0
   60    56    58    74   0.56750  1.0 1.0
   60    56    58    74  -0.07550 -1.0 2.0
   60    56    58    74   0.20000  1.0 3.0
   61    60    64    65   0.13050  1.0 3.0
   61    60    64    66   0.13050  1.0 3.0
   61    60    64    67   0.13050  1.0 3.0
   41    37    39    40   0.15000  1.0 3.0
   41    37    39    43   0.56750  1.0 1.0
   41    37    39    43  -0.07550 -1.0 2.0
   41    37    39    43   0.20000  1.0 3.0
   41    37    39    60   1.36600  1.0 1.0
   41    37    39    60  -0.11450 -1.0 2.0
   41    37    39    60   0.24250  1.0 3.0
   41    46    54    55  -0.37950  1.0 1.0
   41    46    54    55  -0.15600 -1.0 2.0
   41    46    54    55   0.18750  1.0 3.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    48   0.15000  1.0 3.0
   42    41    46    54   0.15000  1.0 3.0
   42    41    49    50   0.19450  1.0 3.0
   46    41    49    50  -0.11600  1.0 1.0
   46    41    49    50  -0.09450 -1.0 2.0
   46    41    49    50   0.21250  1.0 3.0
   47    46    54    55   0.22550  1.0 3.0
   48    46    54    55   0.22550  1.0 3.0
   49    41    46    47   0.23400  1.0 3.0
   49    41    46    48   0.23400  1.0 3.0
   49    41    46    54   0.56750  1.0 1.0
   49    41    46    54  -0.07550 -1.0 2.0
   49    41    46    54   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
END
