* LIGAND DATABASE FILE (OPLS2005)
*
001      78    81    139    225     406
    1     0 S   NP   _N1_     1    29.89859    99.68485   -19.78039
    2     1 S   H    _HN1     2     1.02838    64.76703   166.97790
    3     1 S   H    _H1_     3     1.02792    73.29533   -73.39592
    4     1 S   H    _H2_     4     1.02944    68.60848    44.53955
    5     1 S   CT   _CA1     5     1.50120   174.26909   127.25209
    6     5 S   HC   _HA1     6     1.09595   105.18465    97.78003
    7     5 S   CO3  _C1_     7     1.53848   111.95136   -22.01770
    8     7 S   O2Z  _O11     8     1.26352   115.09164   -56.00852
    9     7 S   O2Z  _O12     9     1.26312   115.01541   122.81781
   10     5 S   CT   _CB1    10     1.53168   107.28887  -144.79538
   11    10 S   HC   HB11    11     1.09818   109.39728   -52.15224
   12    10 S   HC   HB12    12     1.09808   110.62420    64.54860
   13    10 S   CT   _CG1    13     1.52825   112.26255  -173.13550
   14    13 S   HC   HG11    14     1.09282   110.02036   -65.44364
   15    13 S   HC   HG12    15     1.09655   109.97763    53.64031
   16    13 S   C    _CD1    16     1.51696   112.68642   174.61213
   17    16 S   O    _OE1    17     1.22726   123.26418     5.12610
   18    16 S   N    _N2_    18     1.38549   111.55877  -175.05411
   19    18 S   H    _HN2    19     1.01902   118.87104     1.43559
   20    18 S   CT1  _CA2    20     1.46026   123.60345   176.29329
   21    20 S   HC   _HA2    21     1.09750   109.25707    -8.86955
   22    20 S   C    _C2_    22     1.53587   108.23132  -123.86278
   23    22 S   O    _O2_    23     1.23057   122.38527  -149.49490
   24    20 S   CT   _CB2    32     1.53372   111.96301   113.48014
   25    24 S   HC   HB21    33     1.09278   110.24425    53.02563
   26    24 S   HC   HB22    34     1.09221   109.52915   170.68500
   27    22 S   N    _N3_    24     1.38404   113.53312    38.53910
   28    27 S   H    _HN3    25     1.01621   119.44207    -5.62553
   29    24 S   S    _SG2    35     1.83461   111.50995   -69.41022
   30    27 S   CT   _CA3    26     1.45250   123.10535   177.15352
   31    30 S   HC   HA31    27     1.09557   107.83098   -56.54197
   32    30 S   HC   HA32    28     1.09559   107.60375    59.81932
   33    29 S   CA   _C16    36     1.80132   101.34268   164.93558
   34    30 S   CO3  _C3_    29     1.52930   114.22627  -178.45516
   35    34 S   O2Z  _O31    30     1.26364   116.13953     0.16786
   36    34 S   O2Z  _O32    31     1.26463   114.39077  -179.95154
   37    33 S   CA   _C11    37     1.40846   119.48061  -113.48234
   38    37 S   CA   _C12    38     1.39535   120.13929   179.06749
   39    38 S   CA   _C13    39     1.39331   122.77951    -0.53119
   40    39 S   Br   Br3_    40     1.90729   120.09579  -178.60030
   41    38 S   CO4  _C17    45     1.46565   108.97398   177.36300
   42    41 S   O    _O33    46     1.21397   128.57543   177.66913
   43    39 S   CA   _C14    41     1.40658   118.02827     2.67927
   44    43 S   Br   Br2_    42     1.92271   119.54943   178.80351
   45    41 S   OS   _O34    47     1.35957   106.32803    -3.95864
   46    33 S   CA   _C15    43     1.42093   122.60867    69.07680
   47    46 S   Br   Br1_    44     1.92709   119.85109     6.67714
   48    37 S   CT   _C10    48     1.51795   130.78041    -3.36371
   49    48 S   CA   _C9_    49     1.54061   112.03092   -59.84257
   50    48 S   CA   _C18    64     1.53551   117.20962    77.71285
   51    49 S   CA   _C4_    50     1.40660   122.30110   109.94057
   52    51 S   HA   _H3_    51     1.08725   121.05912     0.80113
   53    50 S   CA   _C19    65     1.41099   119.55484   175.10103
   54    53 S   HA   _H6_    66     1.08855   120.31640    -0.52339
   55    51 S   CA   _C5_    52     1.39814   121.34936  -178.49416
   56    55 S   HA   _H4_    53     1.08725   119.27597  -179.91607
   57    53 S   CA   _C20    67     1.39578   121.57471   178.38614
   58    57 S   HA   _H7_    68     1.08667   119.18380  -178.07624
   59    55 S   CA   _C6_    54     1.39255   120.45584     0.54858
   60    57 S   CA   _C21    69     1.39104   119.91661     0.56406
   61    59 S   CA   _C7_    55     1.39245   119.28942    -0.00000
   62    59 S   OH   _O42    62     1.36447   116.08446   179.87489
   63    62 S   HO   _H10    63     0.97489   108.69752  -178.42455
   64    60 S   CA   _C22    70     1.39320   119.48286     2.84840
   65    60 S   OH   _O38    77     1.36506   119.41457  -175.58297
   66    65 S   HO   _H9_    78     0.97510   108.60321    15.69738
   67    49 S   CA   _C8_    56     1.40826   120.27344   -67.63253
   68    67 S   HA   _H5_    57     1.08811   119.90608    -1.35898
   69    61 S   SY   _S2_    58     1.80113   123.35603   179.14866
   70    69 S   OY   _O41    59     1.45980   101.88935   115.87578
   71    69 S   OY   _O39    60     1.46025   102.13221  -123.97100
   72    69 S   OY   _O40    61     1.45989   104.18183    -4.12118
   73    50 S   CA   _C23    71     1.40298   122.96445    -1.88969
   74    73 S   HA   _H8_    72     1.08320   119.93211     1.45037
   75    64 S   SY   _S1_    73     1.80146   120.33544   179.92087
   76    75 S   OY   _O37    74     1.46040   101.52714    70.30071
   77    75 S   OY   _O35    75     1.46073   103.85321  -170.18186
   78    75 S   OY   _O36    76     1.45961   103.03500   -50.56849
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  12   2   1   1  16  11   9   4   6   2   3   2   7   2   1  14
  12  11   8   4   8   4   7   3   7   3   9   9   8   3   1   8
   3   1   5   1   3   2   1   1   5   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    46    47    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    46    47    41    45    48    49    50  
   35    36  
   36  
    0  
   38    39    40    43    46    47    41    42    45    48    49    51    67    50    53    73  
   39    40    43    44    46    41    42    45    48    49    50  
   40    43    44    46    47    41    42    45    48  
   43    44    46    41  
   42    45    48    49    50    43  
   45    48  
   44    46    47  
   46    47  
   48    49    51    67    50    53    73  
   47    48  
    0  
   49    51    52    55    61    67    68    50    53    54    57    64    73    74  
   51    52    55    56    59    61    67    68    69    50    53    73  
   53    54    57    58    60    64    73    74    75    51    67  
   52    55    56    59    61    67    68    62  
   55    56    59    67  
   54    57    58    60    64    73    74    65  
   57    58    60    73  
   56    59    61    67    69    62    63  
   59    61    62  
   58    60    64    73    75    65    66  
   60    64    65  
   61    67    68    69    70    71    72    62    63  
   64    73    74    75    76    77    78    65    66  
   67    68    69    70    71    72    62    63  
   63    67    69  
    0  
   73    74    75    76    77    78    65    66  
   66    73    75  
    0  
   68    69    70    71    72  
   69  
   70    71    72  
   71    72  
   72  
    0  
   74    75    76    77    78  
   75  
   76    77    78  
   77    78  
   78  
    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  -0.320000   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   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.4700   0.4700  -0.200000   2.8000   2.5000   0.001000000  -0.686339560
   41   3.7500   0.1050   0.625000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.4700   0.4700  -0.200000   2.8000   2.5000   0.001000000  -0.686339560
   45   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.4700   0.4700  -0.200000   2.8000   2.5000   0.001000000  -0.686339560
   48   3.5000   0.0660   0.375400   1.9750   1.7500   0.005000000  -0.741685710
   49   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700   0.007500   2.5000   1.7750   0.001000000  -0.843144165
   62   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5500   0.0700   0.007500   2.5000   1.7750   0.001000000  -0.843144165
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5500   0.2500   1.291800   2.0025   1.7750   0.025682759  -1.666211680
   70   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   71   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   72   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   74   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   75   3.5500   0.2500   1.291800   2.0025   1.7750   0.025682759  -1.666211680
   76   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   77   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   78   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
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   250.000  1.760
   33    37   469.000  1.400
   33    46   469.000  1.400
   37    38   469.000  1.400
   37    48   317.000  1.510
   38    39   469.000  1.400
   38    41   310.000  1.470
   39    40   300.000  1.903
   39    43   469.000  1.400
   43    44   300.000  1.903
   43    46   469.000  1.400
   46    47   300.000  1.903
   41    42   570.000  1.229
   41    45   214.000  1.327
   45    48   320.000  1.410
   48    49   317.000  1.510
   48    50   317.000  1.510
   49    51   469.000  1.400
   49    67   469.000  1.400
   51    52   367.000  1.080
   51    55   469.000  1.400
   55    56   367.000  1.080
   55    59   469.000  1.400
   59    61   469.000  1.400
   59    62   450.000  1.364
   61    67   469.000  1.400
   61    69   225.000  1.779
   67    68   367.000  1.080
   69    70   735.000  1.471
   69    71   735.000  1.471
   69    72   735.000  1.471
   62    63   553.000  0.945
   50    53   469.000  1.400
   50    73   469.000  1.400
   53    54   367.000  1.080
   53    57   469.000  1.400
   57    58   367.000  1.080
   57    60   469.000  1.400
   60    64   469.000  1.400
   60    65   450.000  1.364
   64    73   469.000  1.400
   64    75   225.000  1.779
   73    74   367.000  1.080
   75    76   735.000  1.471
   75    77   735.000  1.471
   75    78   735.000  1.471
   65    66   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    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    46    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    48    70.00000  120.00000
   33    46    43    63.00000  120.00000
   33    46    47    75.00000  120.00000
   37    38    39    63.00000  120.00000
   37    38    41    60.00000  119.52600
   37    48    45    85.00000  111.85700
   37    48    49    70.00000  112.04700
   37    48    50    70.00000  112.04700
   38    39    40    75.00000  120.00000
   38    39    43    63.00000  120.00000
   38    41    42    75.00000  123.78400
   38    41    45    81.00000  111.40000
   39    43    44    75.00000  120.00000
   39    43    46    63.00000  120.00000
   43    39    40    75.00000  120.00000
   43    46    47    75.00000  120.00000
   46    33    37    63.00000  120.00000
   46    43    44    75.00000  120.00000
   41    38    39    60.00000  119.52600
   41    45    48    83.00000  116.90000
   45    41    42    83.00000  123.40000
   45    48    49    85.00000  111.85700
   45    48    50    85.00000  111.85700
   48    37    38    70.00000  120.00000
   48    49    51    70.00000  120.00000
   48    49    67    70.00000  120.00000
   48    50    53    70.00000  120.00000
   48    50    73    70.00000  120.00000
   49    51    52    35.00000  120.00000
   49    51    55    63.00000  120.00000
   49    67    61    63.00000  120.00000
   49    67    68    35.00000  120.00000
   51    55    56    35.00000  120.00000
   51    55    59    63.00000  120.00000
   55    51    52    35.00000  120.00000
   55    59    61    63.00000  120.00000
   55    59    62    70.00000  120.00000
   59    55    56    35.00000  120.00000
   59    61    67    63.00000  120.00000
   59    61    69    65.00000  117.06700
   59    62    63    35.00000  113.00000
   61    67    68    35.00000  120.00000
   61    69    70   100.00000  107.67100
   61    69    71   100.00000  107.67100
   61    69    72   100.00000  107.67100
   67    49    51    63.00000  120.00000
   69    61    67    65.00000  117.06700
   71    69    70   115.00000  120.17200
   72    69    70   115.00000  120.17200
   72    69    71   115.00000  120.17200
   62    59    61    70.00000  120.00000
   50    48    49    70.00000  112.04700
   50    53    54    35.00000  120.00000
   50    53    57    63.00000  120.00000
   50    73    64    63.00000  120.00000
   50    73    74    35.00000  120.00000
   53    57    58    35.00000  120.00000
   53    57    60    63.00000  120.00000
   57    53    54    35.00000  120.00000
   57    60    64    63.00000  120.00000
   57    60    65    70.00000  120.00000
   60    57    58    35.00000  120.00000
   60    64    73    63.00000  120.00000
   60    64    75    65.00000  117.06700
   60    65    66    35.00000  113.00000
   64    73    74    35.00000  120.00000
   64    75    76   100.00000  107.67100
   64    75    77   100.00000  107.67100
   64    75    78   100.00000  107.67100
   73    50    53    63.00000  120.00000
   75    64    73    65.00000  117.06700
   77    75    76   115.00000  120.17200
   78    75    76   115.00000  120.17200
   78    75    77   115.00000  120.17200
   65    60    64    70.00000  120.00000
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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    46   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    48   3.62500 -1.0 2.0
   29    33    46    43   3.62500 -1.0 2.0
   29    33    46    47   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    41   3.62500 -1.0 2.0
   33    37    48    45   0.64500  1.0 1.0
   33    37    48    45   0.14800 -1.0 2.0
   33    37    48    45   0.20650  1.0 3.0
   33    37    48    49   0.04300 -1.0 2.0
   33    37    48    50   0.04300 -1.0 2.0
   37    33    46    43   3.62500 -1.0 2.0
   37    33    46    47   3.62500 -1.0 2.0
   37    38    39    40   3.62500 -1.0 2.0
   37    38   -39    43   3.62500 -1.0 2.0
   37    38    41    42   1.05000 -1.0 2.0
   37    38   -41    45   0.98750 -1.0 2.0
   37    48    49    51   0.04300 -1.0 2.0
   37    48    49    67   0.04300 -1.0 2.0
   37    48    50    53   0.04300 -1.0 2.0
   37    48    50    73   0.04300 -1.0 2.0
   38    37   -48    45   0.64500  1.0 1.0
   38    37   -48    45   0.14800 -1.0 2.0
   38    37   -48    45   0.20650  1.0 3.0
   38    37    48    49   0.04300 -1.0 2.0
   38    37    48    50   0.04300 -1.0 2.0
   38    39    43    44   3.62500 -1.0 2.0
   38    39    43    46   3.62500 -1.0 2.0
   38    41   -45    48   0.59950  1.0 1.0
   38    41   -45    48   3.24850 -1.0 2.0
   39    38    41    42   1.05000 -1.0 2.0
   39    38    41    45   0.98750 -1.0 2.0
   39    43   -46    33   3.62500 -1.0 2.0
   39    43    46    47   3.62500 -1.0 2.0
   40    39    43    44   3.62500 -1.0 2.0
   40    39    43    46   3.62500 -1.0 2.0
   44    43    46    33   3.62500 -1.0 2.0
   44    43    46    47   3.62500 -1.0 2.0
   46    33   -37    38   3.62500 -1.0 2.0
   46    33    37    48   3.62500 -1.0 2.0
   41    38    39    40   3.62500 -1.0 2.0
   41    38    39    43   3.62500 -1.0 2.0
   41    45   -48    37  -0.43900 -1.0 2.0
   41    45   -48    37   0.14100  1.0 3.0
   41    45    48    49  -0.43900 -1.0 2.0
   41    45    48    49   0.14100  1.0 3.0
   41    45    48    50  -0.43900 -1.0 2.0
   41    45    48    50   0.14100  1.0 3.0
   42    41    45    48   3.00000 -1.0 2.0
   45    48    49    51   0.64500  1.0 1.0
   45    48    49    51   0.14800 -1.0 2.0
   45    48    49    51   0.20650  1.0 3.0
   45    48    49    67   0.64500  1.0 1.0
   45    48    49    67   0.14800 -1.0 2.0
   45    48    49    67   0.20650  1.0 3.0
   45    48    50    53   0.64500  1.0 1.0
   45    48    50    53   0.14800 -1.0 2.0
   45    48    50    53   0.20650  1.0 3.0
   45    48    50    73   0.64500  1.0 1.0
   45    48    50    73   0.14800 -1.0 2.0
   45    48    50    73   0.20650  1.0 3.0
   48    37    38    39   3.62500 -1.0 2.0
   48    37   -38    41   3.62500 -1.0 2.0
   48    49    51    52   3.62500 -1.0 2.0
   48    49    51    55   3.62500 -1.0 2.0
   48    49    67    61   3.62500 -1.0 2.0
   48    49    67    68   3.62500 -1.0 2.0
   48    50    53    54   3.62500 -1.0 2.0
   48    50    53    57   3.62500 -1.0 2.0
   48    50    73    64   3.62500 -1.0 2.0
   48    50    73    74   3.62500 -1.0 2.0
   49    48    50    53   0.04300 -1.0 2.0
   49    48    50    73   0.04300 -1.0 2.0
   49    51    55    56   3.62500 -1.0 2.0
   49    51    55    59   3.62500 -1.0 2.0
   51    49    67    61   3.62500 -1.0 2.0
   51    49    67    68   3.62500 -1.0 2.0
   51    55   -59    61   3.62500 -1.0 2.0
   51    55    59    62   3.62500 -1.0 2.0
   52    51    55    56   3.62500 -1.0 2.0
   52    51    55    59   3.62500 -1.0 2.0
   55    59    61    67   3.62500 -1.0 2.0
   55    59    61    69   3.62500 -1.0 2.0
   55    59    62    63   0.84100 -1.0 2.0
   56    55    59    61   3.62500 -1.0 2.0
   56    55    59    62   3.62500 -1.0 2.0
   59    61   -67    49   3.62500 -1.0 2.0
   59    61    67    68   3.62500 -1.0 2.0
   59    61    69    70   0.19500  1.0 1.0
   59    61    69    70   0.12000 -1.0 2.0
   59    61    69    71   0.19500  1.0 1.0
   59    61    69    71   0.12000 -1.0 2.0
   59    61    69    72   0.19500  1.0 1.0
   59    61    69    72   0.12000 -1.0 2.0
   61    59    62    63   0.84100 -1.0 2.0
   67    49    51    52   3.62500 -1.0 2.0
   67    49   -51    55   3.62500 -1.0 2.0
   67    61    69    70   0.19500  1.0 1.0
   67    61    69    70   0.12000 -1.0 2.0
   67    61    69    71   0.19500  1.0 1.0
   67    61    69    71   0.12000 -1.0 2.0
   67    61    69    72   0.19500  1.0 1.0
   67    61    69    72   0.12000 -1.0 2.0
   69    61    67    49   3.62500 -1.0 2.0
   69    61    67    68   3.62500 -1.0 2.0
   62    59    61    67   3.62500 -1.0 2.0
   62    59    61    69   3.62500 -1.0 2.0
   50    48    49    51   0.04300 -1.0 2.0
   50    48    49    67   0.04300 -1.0 2.0
   50    53    57    58   3.62500 -1.0 2.0
   50    53    57    60   3.62500 -1.0 2.0
   53    50    73    64   3.62500 -1.0 2.0
   53    50    73    74   3.62500 -1.0 2.0
   53    57   -60    64   3.62500 -1.0 2.0
   53    57    60    65   3.62500 -1.0 2.0
   54    53    57    58   3.62500 -1.0 2.0
   54    53    57    60   3.62500 -1.0 2.0
   57    60    64    73   3.62500 -1.0 2.0
   57    60    64    75   3.62500 -1.0 2.0
   57    60    65    66   0.84100 -1.0 2.0
   58    57    60    64   3.62500 -1.0 2.0
   58    57    60    65   3.62500 -1.0 2.0
   60    64   -73    50   3.62500 -1.0 2.0
   60    64    73    74   3.62500 -1.0 2.0
   60    64    75    76   0.19500  1.0 1.0
   60    64    75    76   0.12000 -1.0 2.0
   60    64    75    77   0.19500  1.0 1.0
   60    64    75    77   0.12000 -1.0 2.0
   60    64    75    78   0.19500  1.0 1.0
   60    64    75    78   0.12000 -1.0 2.0
   64    60    65    66   0.84100 -1.0 2.0
   73    50    53    54   3.62500 -1.0 2.0
   73    50   -53    57   3.62500 -1.0 2.0
   73    64    75    76   0.19500  1.0 1.0
   73    64    75    76   0.12000 -1.0 2.0
   73    64    75    77   0.19500  1.0 1.0
   73    64    75    77   0.12000 -1.0 2.0
   73    64    75    78   0.19500  1.0 1.0
   73    64    75    78   0.12000 -1.0 2.0
   75    64    73    50   3.62500 -1.0 2.0
   75    64    73    74   3.62500 -1.0 2.0
   65    60    64    73   3.62500 -1.0 2.0
   65    60    64    75   3.62500 -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
   35    30    34    36  10.50000 -1.0 2.0
   37    46    33    29   4.00000 -1.0 2.0
   38    48    37    33   4.00000 -1.0 2.0
   39    41    38    37   4.00000 -1.0 2.0
   43    40    39    38   4.00000 -1.0 2.0
   46    44    43    39   4.00000 -1.0 2.0
   43    47    46    33   4.00000 -1.0 2.0
   38    45    41    42  10.50000 -1.0 2.0
   51    67    49    48   4.00000 -1.0 2.0
   55    52    51    49   1.10000 -1.0 2.0
   59    56    55    51   1.10000 -1.0 2.0
   61    62    59    55   4.00000 -1.0 2.0
   67    69    61    59   4.00000 -1.0 2.0
   61    68    67    49   1.10000 -1.0 2.0
   53    73    50    48   4.00000 -1.0 2.0
   57    54    53    50   1.10000 -1.0 2.0
   60    58    57    53   1.10000 -1.0 2.0
   64    65    60    57   4.00000 -1.0 2.0
   73    75    64    60   4.00000 -1.0 2.0
   64    74    73    50   1.10000 -1.0 2.0
END
