* LIGAND DATABASE FILE (OPLS2005)
*
001      76    77    134    210     401
    1     0 S   NP   _N1_     1    28.50665    98.47148   -20.27121
    2     1 S   H    _HN1     2     1.02955    63.79908   -11.23391
    3     1 S   H    _H1_     3     1.02838    51.29066   133.33211
    4     1 S   H    _H2_     4     1.02785    96.08322  -118.63252
    5     1 S   CT   _CA1     5     1.50090   151.03177    73.90623
    6     5 S   HC   _HA1     6     1.09588   105.22714   105.15250
    7     5 S   CO3  _C1_     7     1.53910   112.26725   -14.84028
    8     7 S   O2Z  _O11     8     1.26337   115.02398   -48.70138
    9     7 S   O2Z  _O12     9     1.26319   115.03598   130.49063
   10     5 S   CT   _CB1    10     1.53215   107.36906  -137.18605
   11    10 S   HC   HB11    11     1.09810   109.50696   -52.44719
   12    10 S   HC   HB12    12     1.09805   110.45570    64.27121
   13    10 S   CT   _CG1    13     1.52840   112.27053  -173.51097
   14    13 S   HC   HG11    14     1.09339   109.78115   -64.92164
   15    13 S   HC   HG12    15     1.09645   109.97279    54.15098
   16    13 S   C    _CD1    16     1.51712   112.96745   175.58909
   17    16 S   O    _OE1    17     1.22734   123.31381     7.35946
   18    16 S   N    _N2_    18     1.38616   111.61172  -173.26597
   19    18 S   H    _HN2    19     1.01564   118.96338     4.90852
   20    18 S   CT1  _CA2    20     1.45715   122.90795   178.75888
   21    20 S   HC   _HA2    21     1.09719   108.70923    29.62014
   22    20 S   C    _C2_    22     1.52973   106.91639   -87.56715
   23    22 S   O    _O2_    23     1.22962   122.89093   -29.04060
   24    20 S   CT   _CB2    32     1.53220   112.47750   153.03617
   25    24 S   HC   HB21    33     1.09506   110.42849    56.25925
   26    24 S   HC   HB22    34     1.09565   110.16338   173.72652
   27    22 S   N    _N3_    24     1.38608   112.43879   153.73012
   28    27 S   H    _HN3    25     1.01504   119.73290     1.31448
   29    24 S   S    _SG2    35     1.82859   111.81158   -67.60918
   30    27 S   CT   _CA3    26     1.45454   122.83159   176.07006
   31    30 S   HC   HA31    27     1.09537   108.99581    30.06485
   32    30 S   HC   HA32    28     1.09484   107.21330   147.13448
   33    29 S   CT   _C10    36     1.84607   100.18603   125.59659
   34    33 S   HC   _H3_    37     1.09578   105.70967    43.50272
   35    30 S   CO3  _C3_    29     1.52991   113.28172   -93.11600
   36    35 S   O2Z  _O31    30     1.26393   115.55755   -39.46172
   37    35 S   O2Z  _O32    31     1.26371   114.88738   141.40817
   38    33 S   CA   _C9_    38     1.51997   111.65834   -75.37393
   39    33 S   CM   _C11    50     1.51454   108.44456   160.65258
   40    39 S   HC   _H13    51     1.09078   115.64711    53.64209
   41    38 S   CA   _C4_    39     1.40497   119.66308   115.41256
   42    41 S   HA   _H9_    40     1.08763   120.31768     1.06661
   43    39 S   CMA  _C12    52     1.35490   126.75761  -126.92122
   44    43 S   OM   _O33    53     1.26729   125.80793     1.61882
   45    41 S   CA   _C5_    41     1.39609   120.80235  -178.13303
   46    45 S   HA   _H10    42     1.08612   119.85729   178.92117
   47    43 S   OS   _O34    54     1.41891   109.54647  -179.67494
   48    45 S   CA   _C6_    43     1.39040   119.61757    -0.20558
   49    47 S   CT   _C13    55     1.44220   116.94832   142.62506
   50    49 S   HC   _H4_    56     1.09605   110.73159    33.38489
   51    48 S   CA   _C7_    44     1.39123   120.69418    -1.44888
   52    51 S   HA   _H11    45     1.08627   120.90469  -179.42427
   53    48 S   OH   _O40    48     1.36615   118.36456   177.77630
   54    53 S   HO   _H20    49     0.97669   108.43352  -165.61231
   55    49 S   CT   _C14    57     1.53812   111.29230   -90.46526
   56    55 S   HC   _H5_    58     1.09779   107.80350   176.59659
   57    38 S   CA   _C8_    46     1.40605   121.87902   -64.18664
   58    57 S   HA   _H12    47     1.08741   120.55689    -0.72900
   59    55 S   CT   _C15    59     1.53415   112.08196   -64.15241
   60    59 S   HC   _H6_    60     1.09598   109.73964  -173.52940
   61    55 S   OH   _O39    75     1.42306   111.40786    59.86961
   62    61 S   HO   _H19    76     0.97198   107.89316   176.47097
   63    59 S   CT   _C16    61     1.53612   110.06625   -52.02137
   64    63 S   HC   _H7_    62     1.09796   110.03737   -65.12034
   65    59 S   OH   _O38    73     1.42763   110.71211    69.55389
   66    65 S   HO   _H18    74     0.97367   107.26107    37.61489
   67    63 S   OS   _O35    63     1.43816   110.49913    53.50651
   68    63 S   CT   _C18    68     1.52855   112.03400   173.30772
   69    68 S   HC   _H15    69     1.09437   111.07140    48.92108
   70    68 S   HC   _H16    70     1.09488   111.43139   -73.67656
   71    49 S   CO   _C17    64     1.53918   107.29344   151.81506
   72    71 S   HC   _H8_    65     1.09743   109.98023  -176.93855
   73    68 S   OH   _O37    71     1.42555   109.05023   167.60528
   74    73 S   HO   _H17    72     0.97236   106.94799   177.45778
   75    71 S   OH   _O36    66     1.42396   109.34753   -59.30215
   76    75 S   HO   _H14    67     0.97142   106.72906  -160.24027
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  13   6   2   1   1  12   7   3   8   4   6   2   7   3  10   6
  14   8   5   3   2   1  14   7   1   1  13   7   4   1  12   7
   3   1   8   5   3   2   3   2   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    57    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    57    58    39    40    43    44    47  
   38    41    57    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    51    52    57    58    39    40    43  
   40    43    44    47    49    41    57  
   43    44    47  
   42    45    46    48    51    57    58    53  
   45    46    48    57  
   44    47    49    50    55    71  
   47    49  
   46    48    51    52    57    53    54  
   48    51    53  
   49    50    55    56    59    67    71    72    75    61  
   51    52    57    58    53    54  
   50    55    56    59    60    63    67    71    72    75    76    65    61    62  
   55    56    59    67    71    72    75    61  
   52    57    58    53    54  
   57    58    53  
   54    57  
    0  
   56    59    60    63    64    67    71    72    75    68    65    66    61    62  
   59    60    63    71    65    61    62  
   58  
    0  
   60    63    64    67    71    68    69    70    73    65    66    61    62  
   63    64    67    68    65    66    61  
   62    63    65    71  
    0  
   64    67    71    72    75    68    69    70    73    74    65    66  
   67    71    68    69    70    73    65  
   66    67    68  
    0  
   71    72    75    76    68    69    70    73  
   69    70    73    74    71  
   70    73    74  
   73    74  
   72    75    76  
   75    76  
   74  
    0  
   76  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.5000   0.0660   0.145000   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   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   73   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   75   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    57   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    53   450.000  1.364
   51    52   367.000  1.080
   51    57   469.000  1.400
   57    58   367.000  1.080
   53    54   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   440.000  1.360
   47    49   320.000  1.410
   49    50   340.000  1.090
   49    55   268.000  1.529
   49    71   250.000  1.527
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    61   320.000  1.410
   59    60   340.000  1.090
   59    63   268.000  1.529
   59    65   320.000  1.410
   63    64   340.000  1.090
   63    67   320.000  1.410
   63    68   268.000  1.529
   67    71   320.000  1.380
   71    72   340.000  1.090
   71    75   380.000  1.407
   75    76   553.000  0.945
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    73   320.000  1.410
   73    74   553.000  0.945
   65    66   553.000  0.945
   61    62   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    57    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    57    51    63.00000  120.00000
   38    57    58    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    53    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    57    63.00000  120.00000
   48    53    54    35.00000  113.00000
   51    57    58    35.00000  120.00000
   57    38    41    63.00000  120.00000
   57    51    52    35.00000  120.00000
   53    48    51    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    47    49    90.00000  111.18400
   47    43    44    65.00000  121.00000
   47    49    50    35.00000  109.50000
   47    49    55    50.00000  109.50000
   47    49    71    90.00000  109.38000
   49    55    56    37.50000  110.70000
   49    55    59    58.35000  112.70000
   49    55    61    50.00000  109.50000
   49    71    67    90.00000  108.56700
   49    71    72    45.00000  112.01100
   49    71    75    90.00000  110.19100
   55    49    50    37.50000  110.70000
   55    59    60    37.50000  110.70000
   55    59    63    58.35000  112.70000
   55    59    65    50.00000  109.50000
   55    61    62    55.00000  108.50000
   59    55    56    37.50000  110.70000
   59    63    64    37.50000  110.70000
   59    63    67    50.00000  109.50000
   59    63    68    58.35000  112.70000
   59    65    66    55.00000  108.50000
   63    59    60    37.50000  110.70000
   63    67    71    60.00000  109.50000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    73    50.00000  109.50000
   67    63    64    35.00000  109.50000
   67    71    72    35.00000  109.50000
   67    71    75   110.00000  112.08000
   71    49    50    45.00000  108.72000
   71    49    55    75.00000  109.43000
   71    75    76    70.00000  107.92000
   75    71    72    60.00000  108.02500
   68    63    64    37.50000  110.70000
   68    63    67    50.00000  109.50000
   68    73    74    55.00000  108.50000
   70    68    69    33.00000  107.80000
   73    68    69    35.00000  109.50000
   73    68    70    35.00000  109.50000
   65    59    60    35.00000  109.50000
   65    59    63    50.00000  109.50000
   61    55    56    35.00000  109.50000
   61    55    59    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   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    57    51   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    57    51   3.62500 -1.0 2.0
   41    38    57    58   3.62500 -1.0 2.0
   41    45   -48    51   3.62500 -1.0 2.0
   41    45    48    53   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    57   3.62500 -1.0 2.0
   45    48    53    54   0.84100 -1.0 2.0
   46    45    48    51   3.62500 -1.0 2.0
   46    45    48    53   3.62500 -1.0 2.0
   48    51   -57    38   3.62500 -1.0 2.0
   48    51    57    58   3.62500 -1.0 2.0
   51    48    53    54   0.84100 -1.0 2.0
   52    51    57    38   3.62500 -1.0 2.0
   52    51    57    58   3.62500 -1.0 2.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    45   3.62500 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    57   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    57   0.18050 -1.0 2.0
   39    43    47    49  -2.26850  1.0 1.0
   39    43    47    49   3.39050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    49    50   0.08050  1.0 3.0
   43    47    49    55  -0.46850  1.0 1.0
   43    47    49    55   0.09300 -1.0 2.0
   43    47    49    55  -0.12850  1.0 3.0
   43    47    49    71  -0.46850  1.0 1.0
   43    47    49    71   0.09300 -1.0 2.0
   43    47    49    71  -0.12850  1.0 3.0
   44    43    47    49   2.00000 -1.0 2.0
   47    49    55    56   0.23400  1.0 3.0
   47    49    55    59   0.62750  1.0 1.0
   47    49    55    59  -0.30950 -1.0 2.0
   47    49    55    59   0.27300  1.0 3.0
   47    49    55    61   3.69350  1.0 1.0
   47    49    55    61  -1.82950 -1.0 2.0
   47    49    71    67   1.11900  1.0 1.0
   47    49    71    67  -1.16350 -1.0 2.0
   47    49    71    67  -0.34150  1.0 3.0
   47    49    71    72   0.23400  1.0 3.0
   47    49    71    75   3.69350  1.0 1.0
   47    49    71    75  -1.82950 -1.0 2.0
   49    55    59    60   0.15000  1.0 3.0
   49    55    59    63   0.56750  1.0 1.0
   49    55    59    63  -0.07550 -1.0 2.0
   49    55    59    63   0.20000  1.0 3.0
   49    55    59    65   0.86500  1.0 1.0
   49    55    59    65  -0.17500 -1.0 2.0
   49    55    59    65   0.20800  1.0 3.0
   49    55    61    62  -0.11600  1.0 1.0
   49    55    61    62  -0.09450 -1.0 2.0
   49    55    61    62   0.21250  1.0 3.0
   49    71    75    76  -0.11600  1.0 1.0
   49    71    75    76  -0.09450 -1.0 2.0
   49    71    75    76   0.21250  1.0 3.0
   50    49    55    56   0.15000  1.0 3.0
   50    49    55    59   0.15000  1.0 3.0
   50    49    55    61   0.23400  1.0 3.0
   50    49    71    67   0.23400  1.0 3.0
   50    49    71    72   0.15000  1.0 3.0
   50    49    71    75   0.23400  1.0 3.0
   55    49    71    67   0.62750  1.0 1.0
   55    49    71    67  -0.30950 -1.0 2.0
   55    49    71    67   0.27300  1.0 3.0
   55    49    71    72   0.15000  1.0 3.0
   55    49    71    75   0.86500  1.0 1.0
   55    49    71    75  -0.17500 -1.0 2.0
   55    49    71    75   0.20800  1.0 3.0
   55    59    63    64   0.15000  1.0 3.0
   55    59   -63    67   0.62750  1.0 1.0
   55    59   -63    67  -0.30950 -1.0 2.0
   55    59   -63    67   0.27300  1.0 3.0
   55    59    63    68   0.56750  1.0 1.0
   55    59    63    68  -0.07550 -1.0 2.0
   55    59    63    68   0.20000  1.0 3.0
   55    59    65    66  -0.11600  1.0 1.0
   55    59    65    66  -0.09450 -1.0 2.0
   55    59    65    66   0.21250  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    63   0.15000  1.0 3.0
   56    55    59    65   0.23400  1.0 3.0
   56    55    61    62   0.19450  1.0 3.0
   59    55    61    62  -0.11600  1.0 1.0
   59    55    61    62  -0.09450 -1.0 2.0
   59    55    61    62   0.21250  1.0 3.0
   59    63    67    71   0.06250  1.0 1.0
   59    63    67    71  -0.01100 -1.0 2.0
   59    63    67    71   0.28050  1.0 3.0
   59    63    68    69   0.15000  1.0 3.0
   59    63    68    70   0.15000  1.0 3.0
   59    63    68    73   0.86500  1.0 1.0
   59    63    68    73  -0.17500 -1.0 2.0
   59    63    68    73   0.20800  1.0 3.0
   60    59    63    64   0.15000  1.0 3.0
   60    59    63    67   0.23400  1.0 3.0
   60    59    63    68   0.15000  1.0 3.0
   60    59    65    66   0.19450  1.0 3.0
   63    59    65    66  -0.11600  1.0 1.0
   63    59    65    66  -0.09450 -1.0 2.0
   63    59    65    66   0.21250  1.0 3.0
   63    67   -71    49   0.06250  1.0 1.0
   63    67   -71    49  -0.01100 -1.0 2.0
   63    67   -71    49   0.28050  1.0 3.0
   63    67    71    72   0.37050  1.0 3.0
   63    67    71    75  -0.81800  1.0 1.0
   63    68    73    74  -0.11600  1.0 1.0
   63    68    73    74  -0.09450 -1.0 2.0
   63    68    73    74   0.21250  1.0 3.0
   64    63    67    71   0.37050  1.0 3.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    70   0.15000  1.0 3.0
   64    63    68    73   0.23400  1.0 3.0
   67    63    68    69   0.23400  1.0 3.0
   67    63    68    70   0.23400  1.0 3.0
   67    63    68    73   3.69350  1.0 1.0
   67    63    68    73  -1.82950 -1.0 2.0
   67    71    75    76  -0.50000  1.0 1.0
   67    71    75    76  -0.73950 -1.0 2.0
   67    71    75    76   0.17150  1.0 3.0
   71    49    55    56   0.15000  1.0 3.0
   71    49   -55    59   3.97050  1.0 1.0
   71    49    55    61   0.86500  1.0 1.0
   71    49    55    61  -0.17500 -1.0 2.0
   71    49    55    61   0.20800  1.0 3.0
   72    71    75    76   0.19450  1.0 3.0
   68    63    67    71   0.06250  1.0 1.0
   68    63    67    71  -0.01100 -1.0 2.0
   68    63    67    71   0.28050  1.0 3.0
   69    68    73    74   0.19450  1.0 3.0
   70    68    73    74   0.19450  1.0 3.0
   65    59    63    64   0.23400  1.0 3.0
   65    59    63    67   3.69350  1.0 1.0
   65    59    63    67  -1.82950 -1.0 2.0
   65    59    63    68   0.86500  1.0 1.0
   65    59    63    68  -0.17500 -1.0 2.0
   65    59    63    68   0.20800  1.0 3.0
   61    55    59    60   0.23400  1.0 3.0
   61    55    59    63   0.86500  1.0 1.0
   61    55    59    63  -0.17500 -1.0 2.0
   61    55    59    63   0.20800  1.0 3.0
   61    55    59    65   3.75450  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    57    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   51    53    48    45   4.00000 -1.0 2.0
   57    52    51    48   1.10000 -1.0 2.0
   51    58    57    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    47    43    39  15.00000 -1.0 2.0
END
