* LIGAND DATABASE FILE (OPLS2005)
*
001      73    76    130    219     389
    1     0 S   NP   _N1_     1    28.13119    97.29112   -21.56638
    2     1 S   H    _HN1     2     1.02774   100.11396  -123.44130
    3     1 S   H    _H1_     3     1.02955    73.34306   -17.16638
    4     1 S   H    _H2_     4     1.02833    39.44902   130.63359
    5     1 S   CT   _CA1     5     1.50134   143.25495    84.78875
    6     5 S   HC   _HA1     6     1.09574   105.22118    88.42483
    7     5 S   CO3  _C1_     7     1.53800   112.27460   -31.79045
    8     7 S   O2Z  _O11     8     1.26375   114.98396   -45.35230
    9     7 S   O2Z  _O12     9     1.26217   114.95799   133.61603
   10     5 S   CT   _CB1    10     1.53093   107.40511  -153.64672
   11    10 S   HC   HB11    11     1.09828   109.44459   -50.01376
   12    10 S   HC   HB12    12     1.09812   110.42200    66.60111
   13    10 S   CT   _CG1    13     1.52988   112.56111  -170.99955
   14    13 S   HC   HG11    14     1.09565   110.42337   -64.43135
   15    13 S   HC   HG12    15     1.09648   109.82848    54.85672
   16    13 S   C    _CD1    16     1.51774   112.30074   175.50346
   17    16 S   O    _OE1    17     1.22776   123.19157     6.29099
   18    16 S   N    _N2_    18     1.38578   111.88543  -174.19157
   19    18 S   H    _HN2    19     1.01572   119.11570     4.90900
   20    18 S   CT1  _CA2    20     1.45819   122.61232   178.68657
   21    20 S   HC   _HA2    21     1.09735   108.76868    26.37636
   22    20 S   C    _C2_    22     1.52939   106.94579   -90.69134
   23    22 S   O    _O2_    23     1.22984   123.03807   -27.65007
   24    20 S   CT   _CB2    32     1.53327   112.58544   149.46696
   25    24 S   HC   HB21    33     1.09341   109.62516    58.47241
   26    24 S   HC   HB22    34     1.09377   109.19503   176.68908
   27    22 S   N    _N3_    24     1.38491   112.57831   154.97601
   28    27 S   H    _HN3    25     1.01655   120.35092    -1.52688
   29    24 S   S    _SG2    35     1.83040   110.77354   -63.83324
   30    27 S   CT   _CA3    26     1.45351   122.46516   178.67352
   31    30 S   HC   HA31    27     1.09566   107.69920   -58.35200
   32    30 S   HC   HA32    28     1.09566   107.70900    57.96998
   33    29 S   CT   _C14    36     1.94961   102.32825   164.59643
   34    30 S   CO3  _C3_    29     1.52889   114.34223   179.84174
   35    34 S   O2Z  _O31    30     1.26336   116.06164     0.36691
   36    34 S   O2Z  _O32    31     1.26441   114.41276  -179.64447
   37    33 S   CO4  _C23    37     1.55939   100.23154    66.91786
   38    37 S   O    _O36    38     1.23228   122.36514   -79.05086
   39    33 S   CM   _C12    55     1.56870   108.85656   -54.35801
   40    37 S   CA   _C22    39     1.48973   119.82651    94.47759
   41    39 S   CO4  _C13    56     1.50715   115.88206   -45.23255
   42    41 S   O    _O34    57     1.22573   123.30111   -23.60685
   43    40 S   CA   _C17    40     1.39016   120.89447    -5.66327
   44    41 S   CA   _C8_    58     1.46544   118.08728   155.09172
   45    43 S   CA   _C18    41     1.41102   120.59492  -175.54324
   46    45 S   HA   _H6_    42     1.09202   118.64792  -179.87805
   47    43 S   CO4  _C16    50     1.48191   121.04654     5.83660
   48    47 S   O    _O35    51     1.23071   119.75497  -162.73654
   49    44 S   CA   _C9_    59     1.38543   118.06755    25.54110
   50    45 S   CA   _C19    43     1.41108   123.36337    -0.64194
   51    50 S   OM   _O38    44     1.27676   122.89961   179.94065
   52    33 S   CT   _C15    52     1.56632   106.05670  -174.75761
   53    52 S   OM   _O39    53     1.32601   111.68676   176.04908
   54    52 S   HC   _H3_    54     1.10014   107.07438    44.33488
   55    49 S   CA   _C4_    60     1.40073   120.48567   179.22267
   56    55 S   HA   _H4_    61     1.08670   120.54279  -179.81337
   57    49 S   CO4  _C10    70     1.46775   119.38136     0.95573
   58    57 S   O    _O33    71     1.22955   118.20545   158.64971
   59    50 S   CA   _C20    45     1.40844   114.25772    -0.33804
   60    59 S   HA   _H7_    46     1.09169   118.92308  -179.57433
   61    55 S   CA   _C5_    62     1.39331   119.36473     0.53449
   62    39 S   CMA  _C11    72     1.36434   125.22129   140.41256
   63    62 S   OM   _O40    73     1.26476   130.48168     2.50921
   64    40 S   CA   _C21    47     1.39927   121.38817   177.67847
   65    61 S   CA   _C6_    63     1.39102   120.76934    -0.66027
   66    65 S   HA   _H5_    64     1.08656   120.31949  -179.63523
   67    61 S   OH   _O42    68     1.36626   121.05035   179.57849
   68    67 S   HO   _H10    69     0.97251   108.62032    -0.17246
   69    64 S   OH   _O37    48     1.37112   123.54662    -4.08619
   70    69 S   HO   _H8_    49     0.97420   108.50756    -0.72497
   71    44 S   CA   _C7_    65     1.40146   122.37874  -155.62650
   72    71 S   OH   _O41    66     1.36773   123.05090     0.51738
   73    72 S   HO   _H9_    67     0.97458   108.81634    -9.80945
  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  11   5   4   3
  17   2   1   1  14   5  14  12  11   4  12  12   9   4   6   3
  11   5   3   3   1   1  10   4   5   2   4   2   6   1   1   2
   6   3   2   1   1   1   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    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    52    53    54    39    41    62  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    43    64    47    48    52    53    54    39    41    42    44    57    62    63  
   35    36  
   36  
    0  
   38    40    43    45    59    64    69    47    52    53    54    39    41    62  
   40    43    64    52    39  
   41    42    44    49    71    57    58    62    63    40    47    52    53    54  
   43    45    46    50    59    60    64    69    70    47    48    52  
   42    44    49    55    65    71    72    57    62    63    52  
   44    49    71    62  
   45    46    50    51    59    64    69    47    48    52    53    54  
   49    55    56    61    65    66    71    72    73    57    58    62  
   46    50    51    59    60    64    47    48    52  
   50    51    59    47  
   48    52    53    54    50    64  
   52    53    54  
   55    56    61    65    71    72    67    57    58    62    63  
   51    59    60    64    69  
   59    60    64  
   53    54    62  
   54  
    0  
   56    61    65    66    71    67    68    57    58    62  
   61    65    67    57  
   58    62    63    61    71  
   62    63  
   60    64    69    70  
   64    69  
   65    66    71    72    67    68  
   63  
    0  
   69    70  
   66    71    72    73    67    68  
   71    72    67  
   68    71  
    0  
   70  
    0  
   72    73  
   73  
    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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   52   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   54   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   63   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   64   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   72   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.435000   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    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   317.000  1.522
   33    52   268.000  1.529
   33    39   317.000  1.510
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    43   469.000  1.400
   40    64   469.000  1.400
   43    45   469.000  1.400
   43    47   310.000  1.470
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    51   450.000  1.364
   50    59   469.000  1.400
   59    60   367.000  1.080
   59    64   469.000  1.400
   64    69   450.000  1.364
   69    70   553.000  0.945
   47    48   570.000  1.229
   47    52   317.000  1.522
   52    53   570.000  1.307
   52    54   340.000  1.090
   39    41   320.000  1.462
   39    62   465.000  1.376
   41    42   570.000  1.229
   41    44   310.000  1.470
   44    49   469.000  1.400
   44    71   469.000  1.400
   49    55   469.000  1.400
   49    57   310.000  1.470
   55    56   367.000  1.080
   55    61   469.000  1.400
   61    65   469.000  1.400
   61    67   450.000  1.364
   65    66   367.000  1.080
   65    71   469.000  1.400
   71    72   450.000  1.364
   72    73   553.000  0.945
   67    68   553.000  0.945
   57    58   570.000  1.229
   57    62   270.000  1.476
   62    63   745.000  1.250
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  110.18000
   29    33    52    75.00000  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    52    47    63.00000  111.10000
   33    52    53    50.00000  109.50000
   33    52    54    37.50000  110.70000
   33    39    41    65.00000  116.34900
   33    39    62    70.00000  124.00000
   37    40    43    60.00000  119.52600
   37    40    64    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    43    45    63.00000  120.00000
   40    43    47    60.00000  119.52600
   40    64    59    63.00000  120.00000
   40    64    69    70.00000  120.00000
   43    45    46    35.00000  120.00000
   43    45    50    63.00000  120.00000
   43    47    48    75.00000  123.78400
   43    47    52    65.00000  115.47100
   45    50    51    70.00000  120.00000
   45    50    59    63.00000  120.00000
   50    45    46    35.00000  120.00000
   50    59    60    35.00000  120.00000
   50    59    64    63.00000  120.00000
   59    50    51    70.00000  120.00000
   59    64    69    70.00000  120.00000
   64    40    43    63.00000  120.00000
   64    59    60    35.00000  120.00000
   64    69    70    35.00000  113.00000
   47    43    45    60.00000  119.52600
   47    52    53    90.00000  108.74100
   47    52    54    35.00000  109.50000
   52    33    37    63.00000  111.10000
   52    47    48    80.00000  120.40000
   54    52    53    45.00000  125.66300
   39    33    37    70.00000  109.06800
   39    33    52    70.00000  112.02700
   39    41    42    80.00000  123.72100
   39    41    44    65.00000  117.02400
   39    62    57    65.00000  114.61000
   39    62    63    65.00000  137.10300
   41    44    49    60.00000  119.52600
   41    44    71    60.00000  119.52600
   44    41    42    75.00000  123.78400
   44    49    55    63.00000  120.00000
   44    49    57    60.00000  119.52600
   44    71    65    63.00000  120.00000
   44    71    72    70.00000  120.00000
   49    55    56    35.00000  120.00000
   49    55    61    63.00000  120.00000
   49    57    58    75.00000  123.78400
   49    57    62    60.00000  117.44000
   55    61    65    63.00000  120.00000
   55    61    67    70.00000  120.00000
   61    55    56    35.00000  120.00000
   61    65    66    35.00000  120.00000
   61    65    71    63.00000  120.00000
   61    67    68    35.00000  113.00000
   65    71    72    70.00000  120.00000
   71    44    49    63.00000  120.00000
   71    65    66    35.00000  120.00000
   71    72    73    35.00000  113.00000
   67    61    65    70.00000  120.00000
   57    49    55    60.00000  119.52600
   57    62    63    85.00000  116.28000
   62    39    41    60.00000  125.92000
   62    57    58    80.00000  120.81000
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  -0.62250  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    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    52    47   0.56750  1.0 1.0
   29    33    52    47  -0.07550 -1.0 2.0
   29    33    52    47   0.20000  1.0 3.0
   29    33    52    53   0.56750  1.0 1.0
   29    33    52    53  -0.07550 -1.0 2.0
   29    33    52    53   0.20000  1.0 3.0
   29    33    52    54   0.15000  1.0 3.0
   29    33    39    41   0.09700  1.0 1.0
   29    33    39    41   0.15600 -1.0 2.0
   29    33    39    41  -0.50800  1.0 3.0
   29    33    39    62   0.42700  1.0 1.0
   29    33    39    62  -0.70350 -1.0 2.0
   29    33    39    62  -0.43150  1.0 3.0
   33    37    40    43   2.26350  1.0 1.0
   33    37    40    43   0.76750 -1.0 2.0
   33    37    40    43   0.22500  1.0 3.0
   33    37    40    64   2.26350  1.0 1.0
   33    37    40    64   0.76750 -1.0 2.0
   33    37    40    64   0.22500  1.0 3.0
   33    39    41    42  -0.64400  1.0 1.0
   33    39    41    42   0.26850 -1.0 2.0
   33    39    41    44   1.50000 -1.0 2.0
   33    39    62    57   7.00000 -1.0 2.0
   33    39    62    63   7.00000 -1.0 2.0
   37    33    52    47   0.11950  1.0 1.0
   37    33    52    47   0.20300 -1.0 2.0
   37    33    52    47  -0.70800  1.0 3.0
   37    33    52    53  -0.09450  1.0 1.0
   37    33    52    53  -1.12950 -1.0 2.0
   37    33    52    53   0.54000  1.0 3.0
   37    33    52    54  -0.11250  1.0 3.0
   37    33    39    41   0.09700  1.0 1.0
   37    33    39    41   0.15600 -1.0 2.0
   37    33    39    41  -0.50800  1.0 3.0
   37    33    39    62  -0.51250  1.0 1.0
   37    33    39    62  -0.88800 -1.0 2.0
   37    33    39    62   0.08850  1.0 3.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40   -43    47   3.62500 -1.0 2.0
   37    40    64    59   3.62500 -1.0 2.0
   37    40    64    69   3.62500 -1.0 2.0
   38    37    40    43   1.05000 -1.0 2.0
   38    37    40    64   1.05000 -1.0 2.0
   40    43    45    46   3.62500 -1.0 2.0
   40    43    45    50   3.62500 -1.0 2.0
   40    43    47    48   1.05000 -1.0 2.0
   40    43    47    52   2.26350  1.0 1.0
   40    43    47    52   0.76750 -1.0 2.0
   40    43    47    52   0.22500  1.0 3.0
   40    64    69    70   0.84100 -1.0 2.0
   43    40    64    59   3.62500 -1.0 2.0
   43    40    64    69   3.62500 -1.0 2.0
   43    45    50    51   3.62500 -1.0 2.0
   43    45   -50    59   3.62500 -1.0 2.0
   43    47   -52    33   0.05850 -1.0 2.0
   43    47   -52    33   0.17250  1.0 3.0
   43    47    52    53   0.65300  1.0 1.0
   43    47    52    53  -0.03850 -1.0 2.0
   43    47    52    53   0.33900  1.0 3.0
   43    47    52    54   0.00000  1.0 1.0
   45    43    47    48   1.05000 -1.0 2.0
   45    43    47    52   2.26350  1.0 1.0
   45    43    47    52   0.76750 -1.0 2.0
   45    43    47    52   0.22500  1.0 3.0
   45    50    59    60   3.62500 -1.0 2.0
   45    50    59    64   3.62500 -1.0 2.0
   46    45    50    51   3.62500 -1.0 2.0
   46    45    50    59   3.62500 -1.0 2.0
   50    59   -64    40   3.62500 -1.0 2.0
   50    59    64    69   3.62500 -1.0 2.0
   51    50    59    60   3.62500 -1.0 2.0
   51    50    59    64   3.62500 -1.0 2.0
   59    64    69    70   0.84100 -1.0 2.0
   60    59    64    40   3.62500 -1.0 2.0
   60    59    64    69   3.62500 -1.0 2.0
   64    40   -43    45   3.62500 -1.0 2.0
   64    40    43    47   3.62500 -1.0 2.0
   47    43    45    46   3.62500 -1.0 2.0
   47    43    45    50   3.62500 -1.0 2.0
   48    47    52    33   0.30150 -1.0 2.0
   48    47    52    53   0.30150 -1.0 2.0
   48    47    52    54   0.00000  1.0 1.0
   52    33    37    38   0.30150 -1.0 2.0
   52    33   -37    40   0.05850 -1.0 2.0
   52    33   -37    40   0.17250  1.0 3.0
   52    33    39    41   0.09700  1.0 1.0
   52    33    39    41   0.15600 -1.0 2.0
   52    33    39    41  -0.50800  1.0 3.0
   52    33    39    62   0.09850  1.0 1.0
   52    33    39    62   0.15250 -1.0 2.0
   52    33    39    62  -0.50650  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    52    47  -0.98800  1.0 1.0
   39    33    52    47   0.48800 -1.0 2.0
   39    33    52    47   0.76800  1.0 3.0
   39    33    52    53   0.61850  1.0 1.0
   39    33    52    53  -0.22750 -1.0 2.0
   39    33    52    53   0.15300  1.0 3.0
   39    33    52    54   0.15000  1.0 3.0
   39    41    44    49  -0.11500  1.0 1.0
   39    41    44    49   1.10450 -1.0 2.0
   39    41    44    49  -0.48050  1.0 3.0
   39    41    44    71  -0.11500  1.0 1.0
   39    41    44    71   1.10450 -1.0 2.0
   39    41    44    71  -0.48050  1.0 3.0
   41    39    62    57   7.00000 -1.0 2.0
   41    39    62    63   7.00000 -1.0 2.0
   41    44    49    55   3.62500 -1.0 2.0
   41    44   -49    57   3.62500 -1.0 2.0
   41    44    71    65   3.62500 -1.0 2.0
   41    44    71    72   3.62500 -1.0 2.0
   42    41    44    49   1.05000 -1.0 2.0
   42    41    44    71   1.05000 -1.0 2.0
   44    49    55    56   3.62500 -1.0 2.0
   44    49    55    61   3.62500 -1.0 2.0
   44    49    57    58   1.05000 -1.0 2.0
   44    49    57    62  -0.11500  1.0 1.0
   44    49    57    62   1.10450 -1.0 2.0
   44    49    57    62  -0.48050  1.0 3.0
   44    71    72    73   0.84100 -1.0 2.0
   49    44    71    65   3.62500 -1.0 2.0
   49    44    71    72   3.62500 -1.0 2.0
   49    55   -61    65   3.62500 -1.0 2.0
   49    55    61    67   3.62500 -1.0 2.0
   49    57   -62    39  -1.65800  1.0 1.0
   49    57   -62    39   0.77650 -1.0 2.0
   49    57    62    63   1.50000 -1.0 2.0
   55    49    57    58   1.05000 -1.0 2.0
   55    49    57    62  -0.11500  1.0 1.0
   55    49    57    62   1.10450 -1.0 2.0
   55    49    57    62  -0.48050  1.0 3.0
   55    61    65    66   3.62500 -1.0 2.0
   55    61    65    71   3.62500 -1.0 2.0
   55    61    67    68   0.84100 -1.0 2.0
   56    55    61    65   3.62500 -1.0 2.0
   56    55    61    67   3.62500 -1.0 2.0
   61    65   -71    44   3.62500 -1.0 2.0
   61    65    71    72   3.62500 -1.0 2.0
   65    61    67    68   0.84100 -1.0 2.0
   65    71    72    73   0.84100 -1.0 2.0
   66    65    71    44   3.62500 -1.0 2.0
   66    65    71    72   3.62500 -1.0 2.0
   71    44   -49    55   3.62500 -1.0 2.0
   71    44    49    57   3.62500 -1.0 2.0
   67    61    65    66   3.62500 -1.0 2.0
   67    61    65    71   3.62500 -1.0 2.0
   57    49    55    56   3.62500 -1.0 2.0
   57    49    55    61   3.62500 -1.0 2.0
   58    57    62    39   1.00000 -1.0 2.0
   58    57    62    63  -0.11900  1.0 1.0
   58    57    62    63   0.76850 -1.0 2.0
   58    57    62    63   0.14100  1.0 3.0
   62    39    41    42   1.00000 -1.0 2.0
   62    39   -41    44  -1.65800  1.0 1.0
   62    39   -41    44   0.77650 -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
   33    40    37    38  10.50000 -1.0 2.0
   43    64    40    37   4.00000 -1.0 2.0
   45    47    43    40   4.00000 -1.0 2.0
   50    46    45    43   1.10000 -1.0 2.0
   59    51    50    45   4.00000 -1.0 2.0
   64    60    59    50   1.10000 -1.0 2.0
   59    69    64    40   4.00000 -1.0 2.0
   43    52    47    48  10.50000 -1.0 2.0
   33    41    39    62   1.10000 -1.0 2.0
   39    44    41    42  10.50000 -1.0 2.0
   49    71    44    41   4.00000 -1.0 2.0
   55    57    49    44   4.00000 -1.0 2.0
   61    56    55    49   1.10000 -1.0 2.0
   65    67    61    55   4.00000 -1.0 2.0
   71    66    65    61   1.10000 -1.0 2.0
   65    72    71    44   4.00000 -1.0 2.0
   49    62    57    58  10.50000 -1.0 2.0
   57    63    62    39   1.10000 -1.0 2.0
END
