* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    147    237     443
    1     0 S   NP   _N1_     1    28.62857    95.54958   -23.05924
    2     1 S   H    _HN1     2     1.02952    77.71136    21.90283
    3     1 S   H    _H1_     3     1.02828    34.36150   170.22795
    4     1 S   H    _H2_     4     1.02781   101.39309   -84.65858
    5     1 S   CT   _CA1     5     1.50119   139.62830   129.02188
    6     5 S   HC   _HA1     6     1.09575   105.19503    82.64714
    7     5 S   CO3  _C1_     7     1.53780   112.41796   -37.56193
    8     7 S   O2Z  _O11     8     1.26372   114.99108   -43.07605
    9     7 S   O2Z  _O12     9     1.26236   114.93448   135.98775
   10     5 S   CT   _CB1    10     1.53076   107.41786  -159.40135
   11    10 S   HC   HB11    11     1.09832   109.34145   -49.96447
   12    10 S   HC   HB12    12     1.09813   110.46103    66.63080
   13    10 S   CT   _CG1    13     1.52987   112.61888  -170.96432
   14    13 S   HC   HG11    14     1.09594   110.60554   -65.74692
   15    13 S   HC   HG12    15     1.09670   109.82490    53.48921
   16    13 S   C    _CD1    16     1.51804   112.23715   173.90243
   17    16 S   O    _OE1    17     1.22728   123.30761     5.71155
   18    16 S   N    _N2_    18     1.38616   111.63184  -174.43285
   19    18 S   H    _HN2    19     1.01590   118.93934     1.50831
   20    18 S   CT1  _CA2    20     1.46169   123.43211   178.00227
   21    20 S   HC   _HA2    21     1.09743   109.40668    -1.81650
   22    20 S   C    _C2_    22     1.53537   108.47753  -117.18738
   23    22 S   O    _O2_    23     1.23050   122.32535  -148.46093
   24    20 S   CT   _CB2    32     1.53586   111.57787   120.32863
   25    24 S   HC   HB21    33     1.08978   109.33448    57.07616
   26    24 S   HC   HB22    34     1.09179   109.11421   174.80175
   27    22 S   N    _N3_    24     1.38343   113.61871    39.05724
   28    27 S   H    _HN3    25     1.01609   119.53879    -3.56881
   29    24 S   S    _SG2    35     1.82880   110.87131   -66.11192
   30    27 S   CT   _CA3    26     1.45282   123.18304   177.03601
   31    30 S   HC   HA31    27     1.09550   107.52917   -63.96299
   32    30 S   HC   HA32    28     1.09557   107.95398    52.45901
   33    29 S   CT   _C13    36     1.87527   104.32728   159.75641
   34    30 S   CO3  _C3_    29     1.52948   114.10462   174.44131
   35    34 S   O2Z  _O31    30     1.26374   116.07023    -0.63858
   36    34 S   O2Z  _O32    31     1.26431   114.41106   179.41449
   37    33 S   CT   _C17    37     1.57720   111.72859   -81.44267
   38    37 S   HC   _H9_    38     1.09941   108.48743   169.72058
   39    33 S   CT   _C12    64     1.56083   115.33654    47.30390
   40    39 S   HC   _H7_    65     1.09550   106.20909   166.75441
   41    37 S   CO4  _C16    39     1.51952   102.60948   -78.96376
   42    41 S   O    _O35    40     1.22501   124.67159   163.59704
   43    39 S   OH   _O36    66     1.43228   109.47003   -80.45558
   44    43 S   HO   _H23    67     0.97193   108.32702  -170.83318
   45    37 S   CT   _C18    72     1.52080   120.78887    44.45692
   46    45 S   HC   _H20    73     1.09364   112.44700   -63.32296
   47    45 S   HC   _H21    74     1.09677   109.98182   178.71854
   48    45 S   HC   _H22    75     1.09199   112.00928    60.46411
   49    41 S   CT   _C15    41     1.50066   112.24228   -17.37821
   50    49 S   HC   _H18    42     1.09339   109.58395   110.05755
   51    49 S   HC   _H19    43     1.09334   109.65669  -128.32648
   52    33 S   CT   _C14    44     1.58315   108.88267   169.74591
   53    52 S   HC   _H8_    45     1.10296   106.90963  -174.77955
   54    52 S   CT   _C5_    46     1.54587   119.42727   -54.55151
   55    54 S   HC   _H3_    47     1.09633   110.06263    59.34325
   56    54 S   CT   _C6_    48     1.53866   112.66405   -62.38298
   57    56 S   HC   _H13    49     1.09898   108.71683  -166.83734
   58    56 S   HC   _H14    50     1.09550   110.50015   -52.30137
   59    54 S   CT   _C4_    68     1.53999   110.82838   176.55457
   60    59 S   HC   _H10    69     1.09532   111.23230    57.36144
   61    59 S   HC   _H11    70     1.09432   111.49002   -63.70574
   62    59 S   HC   _H12    71     1.09564   110.90911   177.54361
   63    56 S   CT   _C7_    51     1.52241   113.80459    73.54294
   64    63 S   HC   _H4_    52     1.09555   109.16515    44.16226
   65    63 S   CT   _C8_    53     1.51978   117.82627   -82.39706
   66    65 S   HC   _H5_    54     1.09816   105.55861   155.73856
   67    65 S   CT   _C9_    55     1.53986   104.21205   -95.95863
   68    67 S   HC   _H6_    56     1.09671   109.09734  -138.19072
   69    67 S   CO4  _C10    57     1.50337   102.45444   -23.62902
   70    69 S   O    _O33    58     1.22180   125.37454  -166.64212
   71    67 S   CT   _C11    60     1.52222   117.83349    96.29456
   72    71 S   HC   _H15    61     1.09358   112.17855   -54.07910
   73    71 S   HC   _H16    62     1.09610   110.49974  -173.22121
   74    71 S   HC   _H17    63     1.09399   111.39666    67.82799
   75    63 S   OS   _O34    59     1.44151   108.50229   158.71972
  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  13   5   4   3
  25   2   1   1  17   9  19   7  11   5   6   1   5   2   1   1
   8   4   3  12   4  12   8  13   6   5   4   2   1   1   9   5
  10   5   8   7   6   2   4   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    49    52    53    54    65    39    40    43    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    49    50    51    52    53    54    55    56    63    65    66    67    39    40    43    44    59    45    46    47    48  
   35    36  
   36  
    0  
   38    41    42    49    50    51    52    53    54    65    39    40    43    45    46    47    48  
   41    42    49    52    39    45    46    47    48  
   40    43    44    45    41    49    52    53    54    56    63    64    65    66    67    68    69    71    75  
   43    44    52    63    65    66    67  
   42    49    50    51    52    53    54    45    46    47    48  
   49    50    51    52    45  
   44    52    63    65    66    67  
   65  
   46    47    48    49    52  
   47    48  
   48  
    0  
   50    51    52    53    54    55    56    59  
   51    52    53    54  
   52    53    54  
   53    54    55    56    57    58    63    65    59    60    61    62  
   54    55    56    59  
   55    56    57    58    63    64    65    75    59    60    61    62  
   56    57    58    63    59    60    61    62  
   57    58    63    64    65    66    67    69    75    59    60    61    62  
   58    63    64    65    75    59  
   63    64    65    75    59  
   60    61    62    63  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70    75    71  
   65    66    67    69    75  
   66    67    68    69    70    75    71    72    73    74  
   67    68    69    75    71  
   68    69    70    75    71    72    73    74  
   69    70    75    71    72    73    74  
   70    75    71    72    73    74  
   75    71  
   72    73    74    75  
   73    74  
   74  
    0  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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   222.000  1.810
   33    37   268.000  1.529
   33    52   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   317.000  1.522
   37    45   268.000  1.529
   41    42   570.000  1.229
   41    49   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    59   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    63   268.000  1.529
   63    64   340.000  1.090
   63    65   268.000  1.529
   63    75   320.000  1.410
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    39   268.000  1.529
   67    68   340.000  1.090
   67    69   317.000  1.522
   67    71   268.000  1.529
   69    70   570.000  1.229
   69    75   214.000  1.327
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   39    40   340.000  1.090
   39    43   320.000  1.410
   43    44   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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   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    37    75.00000  111.63000
   29    33    52    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    37    45    58.35000  112.70000
   33    52    49    58.35000  112.70000
   33    52    53    37.50000  110.70000
   33    52    54    58.35000  112.70000
   33    39    65    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    43    50.00000  109.50000
   37    41    42    80.00000  120.40000
   37    41    49    70.00000  116.00000
   37    45    46    37.50000  110.70000
   37    45    47    37.50000  110.70000
   37    45    48    37.50000  110.70000
   41    37    38    35.00000  109.50000
   41    49    50    35.00000  109.50000
   41    49    51    35.00000  109.50000
   41    49    52    63.00000  111.10000
   49    41    42    80.00000  120.40000
   49    52    53    37.50000  110.70000
   49    52    54    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    33    37    58.35000  112.70000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    54    55    37.50000  110.70000
   52    54    56    58.35000  112.70000
   52    54    59    58.35000  112.70000
   54    52    53    37.50000  110.70000
   54    56    57    37.50000  110.70000
   54    56    58    37.50000  110.70000
   54    56    63    58.35000  112.70000
   54    59    60    37.50000  110.70000
   54    59    61    37.50000  110.70000
   54    59    62    37.50000  110.70000
   56    54    55    37.50000  110.70000
   56    63    64    37.50000  110.70000
   56    63    65    58.35000  112.70000
   56    63    75    50.00000  109.50000
   58    56    57    33.00000  107.80000
   63    56    57    37.50000  110.70000
   63    56    58    37.50000  110.70000
   63    65    66    37.50000  110.70000
   63    65    67    58.35000  112.70000
   63    65    39    58.35000  112.70000
   63    75    69    83.00000  116.90000
   65    63    64    37.50000  110.70000
   65    67    68    37.50000  110.70000
   65    67    69    63.00000  111.10000
   65    67    71    58.35000  112.70000
   65    39    40    37.50000  110.70000
   65    39    43    50.00000  109.50000
   67    65    66    37.50000  110.70000
   67    69    70    80.00000  120.40000
   67    69    75    81.00000  111.40000
   67    71    72    37.50000  110.70000
   67    71    73    37.50000  110.70000
   67    71    74    37.50000  110.70000
   69    67    68    35.00000  109.50000
   75    63    64    35.00000  109.50000
   75    63    65    50.00000  109.50000
   75    69    70    83.00000  123.40000
   71    67    68    37.50000  110.70000
   71    67    69    63.00000  111.10000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    52    58.35000  112.70000
   39    65    66    37.50000  110.70000
   39    65    67    58.35000  112.70000
   39    43    44    55.00000  108.50000
   43    39    40    35.00000  109.50000
   59    54    55    37.50000  110.70000
   59    54    56    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   45    37    38    37.50000  110.70000
   45    37    41    63.00000  111.10000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  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
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    37    38   0.15000  1.0 3.0
   29    33    37    41   0.56750  1.0 1.0
   29    33    37    41  -0.07550 -1.0 2.0
   29    33    37    41   0.20000  1.0 3.0
   29    33    37    45   0.44750  1.0 1.0
   29    33    37    45  -0.17800 -1.0 2.0
   29    33    37    45   0.20200  1.0 3.0
   29    33    52    49   0.44750  1.0 1.0
   29    33    52    49  -0.17800 -1.0 2.0
   29    33    52    49   0.20200  1.0 3.0
   29    33    52    53   0.15000  1.0 3.0
   29    33    52    54   0.44750  1.0 1.0
   29    33    52    54  -0.17800 -1.0 2.0
   29    33    52    54   0.20200  1.0 3.0
   29    33    39    65   0.44750  1.0 1.0
   29    33    39    65  -0.17800 -1.0 2.0
   29    33    39    65   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    37    41    42   0.30150 -1.0 2.0
   33    37   -41    49   0.60050  1.0 1.0
   33    37   -41    49   0.05600 -1.0 2.0
   33    37   -41    49   0.26150  1.0 3.0
   33    37    45    46   0.15000  1.0 3.0
   33    37    45    47   0.15000  1.0 3.0
   33    37    45    48   0.15000  1.0 3.0
   33    52    54    55   0.15000  1.0 3.0
   33    52    54    56   0.56750  1.0 1.0
   33    52    54    56  -0.07550 -1.0 2.0
   33    52    54    56   0.20000  1.0 3.0
   33    52    54    59   0.56750  1.0 1.0
   33    52    54    59  -0.07550 -1.0 2.0
   33    52    54    59   0.20000  1.0 3.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   37    33   -52    49   0.56750  1.0 1.0
   37    33   -52    49  -0.07550 -1.0 2.0
   37    33   -52    49   0.20000  1.0 3.0
   37    33    52    53   0.15000  1.0 3.0
   37    33    52    54   0.56750  1.0 1.0
   37    33    52    54  -0.07550 -1.0 2.0
   37    33    52    54   0.20000  1.0 3.0
   37    33    39    65   0.56750  1.0 1.0
   37    33    39    65  -0.07550 -1.0 2.0
   37    33    39    65   0.20000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   0.86500  1.0 1.0
   37    33    39    43  -0.17500 -1.0 2.0
   37    33    39    43   0.20800  1.0 3.0
   37    41    49    50   0.00000  1.0 1.0
   37    41    49    51   0.00000  1.0 1.0
   37    41   -49    52   0.60050  1.0 1.0
   37    41   -49    52   0.05600 -1.0 2.0
   37    41   -49    52   0.26150  1.0 3.0
   38    37    41    42   0.00000  1.0 1.0
   38    37    41    49   0.00000  1.0 1.0
   38    37    45    46   0.15000  1.0 3.0
   38    37    45    47   0.15000  1.0 3.0
   38    37    45    48   0.15000  1.0 3.0
   41    37    45    46  -0.11250  1.0 3.0
   41    37    45    47  -0.11250  1.0 3.0
   41    37    45    48  -0.11250  1.0 3.0
   41    49   -52    33  -0.95700  1.0 1.0
   41    49   -52    33  -0.18200 -1.0 2.0
   41    49   -52    33   0.29450  1.0 3.0
   41    49    52    53  -0.11250  1.0 3.0
   41    49    52    54  -0.95700  1.0 1.0
   41    49    52    54  -0.18200 -1.0 2.0
   41    49    52    54   0.29450  1.0 3.0
   42    41    49    50   0.00000  1.0 1.0
   42    41    49    51   0.00000  1.0 1.0
   42    41    49    52   0.30150 -1.0 2.0
   49    52    54    55   0.15000  1.0 3.0
   49    52    54    56   0.56750  1.0 1.0
   49    52    54    56  -0.07550 -1.0 2.0
   49    52    54    56   0.20000  1.0 3.0
   49    52    54    59   0.56750  1.0 1.0
   49    52    54    59  -0.07550 -1.0 2.0
   49    52    54    59   0.20000  1.0 3.0
   50    49    52    33   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   51    49    52    33   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54   0.15000  1.0 3.0
   52    33    37    38   0.15000  1.0 3.0
   52    33   -37    41  -0.95700  1.0 1.0
   52    33   -37    41  -0.18200 -1.0 2.0
   52    33   -37    41   0.29450  1.0 3.0
   52    33    37    45   0.56750  1.0 1.0
   52    33    37    45  -0.07550 -1.0 2.0
   52    33    37    45   0.20000  1.0 3.0
   52    33    39    65   0.56750  1.0 1.0
   52    33    39    65  -0.07550 -1.0 2.0
   52    33    39    65   0.20000  1.0 3.0
   52    33    39    40   0.15000  1.0 3.0
   52    33    39    43   0.86500  1.0 1.0
   52    33    39    43  -0.17500 -1.0 2.0
   52    33    39    43   0.20800  1.0 3.0
   52    54    56    57   0.15000  1.0 3.0
   52    54    56    58   0.15000  1.0 3.0
   52    54    56    63   0.56750  1.0 1.0
   52    54    56    63  -0.07550 -1.0 2.0
   52    54    56    63   0.20000  1.0 3.0
   52    54    59    60   0.15000  1.0 3.0
   52    54    59    61   0.15000  1.0 3.0
   52    54    59    62   0.15000  1.0 3.0
   53    52    54    55   0.15000  1.0 3.0
   53    52    54    56   0.15000  1.0 3.0
   53    52    54    59   0.15000  1.0 3.0
   54    56    63    64   0.15000  1.0 3.0
   54    56    63    65   0.56750  1.0 1.0
   54    56    63    65  -0.07550 -1.0 2.0
   54    56    63    65   0.20000  1.0 3.0
   54    56    63    75   0.62750  1.0 1.0
   54    56    63    75  -0.30950 -1.0 2.0
   54    56    63    75   0.27300  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    63   0.15000  1.0 3.0
   55    54    59    60   0.15000  1.0 3.0
   55    54    59    61   0.15000  1.0 3.0
   55    54    59    62   0.15000  1.0 3.0
   56    54    59    60   0.15000  1.0 3.0
   56    54    59    61   0.15000  1.0 3.0
   56    54    59    62   0.15000  1.0 3.0
   56    63    65    66   0.15000  1.0 3.0
   56    63    65    67   0.56750  1.0 1.0
   56    63    65    67  -0.07550 -1.0 2.0
   56    63    65    67   0.20000  1.0 3.0
   56    63    65    39   0.56750  1.0 1.0
   56    63    65    39  -0.07550 -1.0 2.0
   56    63    65    39   0.20000  1.0 3.0
   56    63    75    69  -0.25900  1.0 1.0
   56    63    75    69  -0.47000 -1.0 2.0
   56    63    75    69   0.11750  1.0 3.0
   57    56    63    64   0.15000  1.0 3.0
   57    56    63    65   0.15000  1.0 3.0
   57    56    63    75   0.23400  1.0 3.0
   58    56    63    64   0.15000  1.0 3.0
   58    56    63    65   0.15000  1.0 3.0
   58    56    63    75   0.23400  1.0 3.0
   63    65    67    68   0.15000  1.0 3.0
   63    65   -67    69  -0.95700  1.0 1.0
   63    65   -67    69  -0.18200 -1.0 2.0
   63    65   -67    69   0.29450  1.0 3.0
   63    65    67    71   0.56750  1.0 1.0
   63    65    67    71  -0.07550 -1.0 2.0
   63    65    67    71   0.20000  1.0 3.0
   63    65    39    33   0.56750  1.0 1.0
   63    65    39    33  -0.07550 -1.0 2.0
   63    65    39    33   0.20000  1.0 3.0
   63    65    39    40   0.15000  1.0 3.0
   63    65    39    43   0.86500  1.0 1.0
   63    65    39    43  -0.17500 -1.0 2.0
   63    65    39    43   0.20800  1.0 3.0
   64    63    65    66   0.15000  1.0 3.0
   64    63    65    67   0.15000  1.0 3.0
   64    63    65    39   0.15000  1.0 3.0
   64    63    75    69   0.08050  1.0 3.0
   65    63   -75    69  -0.25900  1.0 1.0
   65    63   -75    69  -0.47000 -1.0 2.0
   65    63   -75    69   0.11750  1.0 3.0
   65    67    69    70   0.30150 -1.0 2.0
   65    67   -69    75   0.36750  1.0 3.0
   65    67    71    72   0.15000  1.0 3.0
   65    67    71    73   0.15000  1.0 3.0
   65    67    71    74   0.15000  1.0 3.0
   65    39    43    44  -0.11600  1.0 1.0
   65    39    43    44  -0.09450 -1.0 2.0
   65    39    43    44   0.21250  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69  -0.11250  1.0 3.0
   66    65    67    71   0.15000  1.0 3.0
   66    65    39    33   0.15000  1.0 3.0
   66    65    39    40   0.15000  1.0 3.0
   66    65    39    43   0.23400  1.0 3.0
   67    65    39    33   0.56750  1.0 1.0
   67    65    39    33  -0.07550 -1.0 2.0
   67    65    39    33   0.20000  1.0 3.0
   67    65    39    40   0.15000  1.0 3.0
   67    65    39    43   0.86500  1.0 1.0
   67    65    39    43  -0.17500 -1.0 2.0
   67    65    39    43   0.20800  1.0 3.0
   67    69   -75    63   1.63150  1.0 1.0
   67    69   -75    63   2.92000 -1.0 2.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    69    75   0.00000  1.0 1.0
   68    67    71    72   0.15000  1.0 3.0
   68    67    71    73   0.15000  1.0 3.0
   68    67    71    74   0.15000  1.0 3.0
   69    67    71    72  -0.11250  1.0 3.0
   69    67    71    73  -0.11250  1.0 3.0
   69    67    71    74  -0.11250  1.0 3.0
   70    69    75    63   3.00000 -1.0 2.0
   75    63    65    66   0.23400  1.0 3.0
   75    63   -65    67   0.62750  1.0 1.0
   75    63   -65    67  -0.30950 -1.0 2.0
   75    63   -65    67   0.27300  1.0 3.0
   75    63    65    39   0.62750  1.0 1.0
   75    63    65    39  -0.30950 -1.0 2.0
   75    63    65    39   0.27300  1.0 3.0
   71    67    69    70   0.30150 -1.0 2.0
   71    67    69    75   0.36750  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41  -0.95700  1.0 1.0
   39    33    37    41  -0.18200 -1.0 2.0
   39    33    37    41   0.29450  1.0 3.0
   39    33    37    45   0.56750  1.0 1.0
   39    33    37    45  -0.07550 -1.0 2.0
   39    33    37    45   0.20000  1.0 3.0
   39    33    52    49   0.56750  1.0 1.0
   39    33    52    49  -0.07550 -1.0 2.0
   39    33    52    49   0.20000  1.0 3.0
   39    33    52    53   0.15000  1.0 3.0
   39    33    52    54   0.56750  1.0 1.0
   39    33    52    54  -0.07550 -1.0 2.0
   39    33    52    54   0.20000  1.0 3.0
   39    65    67    68   0.15000  1.0 3.0
   39    65    67    69  -0.95700  1.0 1.0
   39    65    67    69  -0.18200 -1.0 2.0
   39    65    67    69   0.29450  1.0 3.0
   39    65    67    71   0.56750  1.0 1.0
   39    65    67    71  -0.07550 -1.0 2.0
   39    65    67    71   0.20000  1.0 3.0
   40    39    43    44   0.19450  1.0 3.0
   59    54    56    57   0.15000  1.0 3.0
   59    54    56    58   0.15000  1.0 3.0
   59    54    56    63   0.56750  1.0 1.0
   59    54    56    63  -0.07550 -1.0 2.0
   59    54    56    63   0.20000  1.0 3.0
   45    37    41    42   0.30150 -1.0 2.0
   45    37    41    49   0.60050  1.0 1.0
   45    37    41    49   0.05600 -1.0 2.0
   45    37    41    49   0.26150  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
   37    49    41    42  10.50000 -1.0 2.0
   67    75    69    70  10.50000 -1.0 2.0
END
