* LIGAND DATABASE FILE (OPLS2005)
*
001      82    85    164    273     498
    1     0 S   NP   _N1_     1    28.70407    94.08315   -21.36010
    2     1 S   H    _HN1     2     1.02782    91.28676   -88.81470
    3     1 S   H    _H1_     3     1.02960    91.97847    19.54962
    4     1 S   H    _H2_     4     1.02837    28.06976   143.57308
    5     1 S   CT   _CA1     5     1.50110   138.83028   144.29265
    6     5 S   HC   _HA1     6     1.09573   105.25359    58.88016
    7     5 S   CO3  _C1_     7     1.53761   112.31641   -61.37982
    8     7 S   O2Z  _O11     8     1.26367   115.04599   -45.74645
    9     7 S   O2Z  _O12     9     1.26236   114.90549   133.40712
   10     5 S   CT   _CB1    10     1.53068   107.42723   176.78734
   11    10 S   HC   HB11    11     1.09825   109.36535   -50.66680
   12    10 S   HC   HB12    12     1.09824   110.39572    65.87045
   13    10 S   CT   _CG1    13     1.53022   112.70123  -171.77567
   14    13 S   HC   HG11    14     1.09580   110.40777   -62.46261
   15    13 S   HC   HG12    15     1.09637   110.07266    56.79399
   16    13 S   C    _CD1    16     1.51806   112.17252   177.12642
   17    16 S   O    _OE1    17     1.22731   123.19385    -4.73838
   18    16 S   N    _N2_    18     1.38623   111.71532   175.45929
   19    18 S   H    _HN2    19     1.01576   119.08692     1.72136
   20    18 S   CT1  _CA2    20     1.46290   123.30650  -178.13282
   21    20 S   HC   _HA2    21     1.09730   109.38305    -8.48744
   22    20 S   C    _C2_    22     1.53399   108.47542  -124.25565
   23    22 S   O    _O2_    23     1.23018   122.22369  -145.88518
   24    20 S   CT   _CB2    32     1.53413   111.38574   113.39123
   25    24 S   HC   HB21    33     1.09589   109.64162    57.32565
   26    24 S   HC   HB22    34     1.09498   110.52765   176.37782
   27    22 S   N    _N3_    24     1.38504   113.40870    41.44155
   28    27 S   H    _HN3    25     1.01520   118.90651    -0.65938
   29    24 S   S    _SG2    35     1.82649   111.52175   -63.37252
   30    27 S   CT   _CA3    26     1.45456   123.52500   175.14881
   31    30 S   HC   HA31    27     1.09516   109.33690    22.53105
   32    30 S   HC   HA32    28     1.09498   107.10103   139.54975
   33    29 S   CT   _C14    36     1.85887    99.58112   170.87975
   34    33 S   HC   _H3_    37     1.09622   107.29336   -22.54399
   35    30 S   CO3  _C3_    29     1.52917   113.02921  -101.01469
   36    35 S   O2Z  _O31    30     1.26407   115.36691   -45.33446
   37    35 S   O2Z  _O32    31     1.26349   115.00668   135.57577
   38    33 S   CM   _C5_    38     1.50902   104.97081    92.41974
   39    38 S   HC   _H24    39     1.08844   117.21043   -80.68510
   40    38 S   CMA  _C6_    40     1.34737   123.22442    98.09298
   41    40 S   OM   _O20    41     1.25922   130.87699  -178.64362
   42    40 S   CM   _C4_    42     1.46280   117.57765     0.97639
   43    42 S   HC   _H23    43     1.09002   117.87059  -168.33144
   44    42 S   CM   _C7_    44     1.35034   123.26957    16.69757
   45    44 S   CT   _C8_    45     1.50806   119.79663   170.59253
   46    45 S   HC   _H25    46     1.09768   108.21876   -96.09162
   47    45 S   HC   _H26    47     1.09695   111.02045    20.35752
   48    45 S   CT   _C9_    48     1.52182   113.54231   142.97458
   49    48 S   HC   _H27    49     1.09618   108.60636   175.19046
   50    48 S   HC   _H28    50     1.09768   109.74771   -68.37258
   51    48 S   CT   _C15    51     1.53312   111.00869    53.84574
   52    51 S   HC   _H38    52     1.09528   108.08256    59.22712
   53    51 S   CT   _C16    53     1.56003   109.30699   -60.66909
   54    53 S   HC   _H39    54     1.09781   103.77705   -59.65697
   55    53 S   CT   _C11    55     1.55478   112.06854  -173.17901
   56    55 S   HC   _H31    56     1.09397   110.37216   -72.21543
   57    55 S   HC   _H32    57     1.09493   110.21326   170.99911
   58    33 S   CT   _C19    78     1.58788   115.38784  -142.50635
   59    55 S   CT   _C13    58     1.53871   113.49265    49.78956
   60    59 S   HC   _H35    59     1.09764   108.53529    68.57863
   61    59 S   HC   _H36    60     1.09655   109.69188  -175.61211
   62    58 S   CT   _C21    79     1.55698   107.54915   162.12659
   63    62 S   HC   _H42    80     1.09485   111.72126   -54.69220
   64    62 S   HC   _H43    81     1.09480   112.11262  -175.59780
   65    62 S   HC   _H44    82     1.09672   111.88674    64.44000
   66    59 S   CT   _C20    61     1.53437   111.30947   -52.79848
   67    51 S   CT   _C17    62     1.53328   111.27987   179.31272
   68    67 S   HC   _H40    63     1.10336   106.74456    61.31141
   69    66 S   CT   _C22    74     1.54983   109.68118   -68.30843
   70    69 S   HC   _H45    75     1.09467   112.41489  -176.48119
   71    69 S   HC   _H46    76     1.09307   112.83302    62.68850
   72    69 S   HC   _H47    77     1.09627   110.56865   -56.93231
   73    67 S   CT   _C10    64     1.52632   119.17883   -58.34694
   74    73 S   HC   _H29    65     1.09471   112.05857    78.74047
   75    73 S   HC   _H30    66     1.09565   111.49167   -41.99814
   76    73 S   CT   _C12    67     1.53959   103.99919  -160.98603
   77    76 S   HC   _H33    68     1.09575   110.82567   130.68600
   78    76 S   HC   _H34    69     1.09584   110.78581  -110.81264
   79    66 S   CT   _C18    70     1.53995   114.60913   166.99801
   80    79 S   HC   _H41    71     1.09566   110.43899   -38.64526
   81    79 S   OH   _O21    72     1.41474   113.03546    82.43648
   82    81 S   HO   _H48    73     0.97250   107.19873   179.73166
  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   9   5   4   3
  17   7   2   1   1   9   4   6   3   9   3  15  11   6   5  12
   5   4  18   8  16   7  11   6   5   6  14   5   4   3   2   1
   1  16  14   6   8   3   2   1   8   5   4   6   4   3   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    58    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    53    58    62  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    51    53    54    55    58    62    63    64    65  
   38    39    40    44    53    58    62  
   36    37  
   37  
    0  
   39    40    41    42    43    44    53    58    62  
   40    41    42    58  
   41    42    43    44    45    58  
   42    43    44  
   43    44    45    46    47    48    53    58    62  
   44    45    58  
   45    46    47    48    49    50    51    53    54    55    58    62    63    64    65  
   46    47    48    49    50    51    52    53    67    58    62  
   47    48    49    50    51    58  
   48    49    50    51    58  
   49    50    51    52    53    54    55    66    67    68    73    58  
   50    51    52    53    67  
   51    52    53    67  
   52    53    54    55    56    57    59    66    67    68    73    74    75    76    79    69    58    62  
   53    54    55    66    67    68    73    58  
   54    55    56    57    59    60    61    66    67    68    73    58    62    63    64    65  
   55    56    57    59    67    58    62  
   56    57    59    60    61    66    67    79    69    58    62  
   57    59    60    61    66    58  
   59    60    61    66    58  
   62    63    64    65    59    67  
   60    61    66    67    68    73    76    79    80    81    69    70    71    72  
   61    66    67    79    69  
   66    67    79    69  
   63    64    65  
   64    65  
   65  
    0  
   67    68    73    74    75    76    77    78    79    80    81    82    69    70    71    72  
   68    73    74    75    76    77    78    79    80    81    69    70    71    72  
   73    74    75    76    79    69  
   70    71    72    73    76    79    80    81  
   71    72    79  
   72    79  
   79  
   74    75    76    77    78    79    80    81  
   75    76    77    78    79  
   76    77    78    79  
   77    78    79    80    81    82  
   78    79    80    81  
   79    80    81  
   80    81    82  
   81    82  
   82  
    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   0.107500   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   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   82   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    58   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   340.000  1.080
   42    44   549.000  1.340
   44    45   317.000  1.510
   44    58   317.000  1.510
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    67   268.000  1.529
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    66   268.000  1.529
   66    67   268.000  1.529
   66    79   268.000  1.529
   66    69   268.000  1.529
   67    68   340.000  1.090
   67    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   268.000  1.529
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   268.000  1.529
   79    80   340.000  1.090
   79    81   320.000  1.410
   81    82   553.000  0.945
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   58    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   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    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    75.00000  112.20000
   29    33    58    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    58    44    70.00000  112.02700
   33    58    53    58.35000  112.70000
   33    58    62    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    40.00000  120.50800
   40    42    44    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    44    45    70.00000  124.00000
   42    44    58    70.00000  124.00000
   44    42    43    35.00000  120.00000
   44    45    46    35.00000  109.50000
   44    45    47    35.00000  109.50000
   44    45    48    70.00000  112.02700
   44    58    53    70.00000  112.02700
   44    58    62    70.00000  112.02700
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    67    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    55    58.35000  112.70000
   51    53    58    58.35000  112.70000
   51    67    66    58.35000  112.70000
   51    67    68    37.50000  110.70000
   51    67    73    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    59    58.35000  112.70000
   53    58    62    58.35000  112.70000
   55    53    54    37.50000  110.70000
   55    59    60    37.50000  110.70000
   55    59    61    37.50000  110.70000
   55    59    66    58.35000  112.70000
   57    55    56    33.00000  107.80000
   59    55    56    37.50000  110.70000
   59    55    57    37.50000  110.70000
   59    66    67    58.35000  112.70000
   59    66    79    58.35000  112.70000
   59    66    69    58.35000  112.70000
   61    59    60    33.00000  107.80000
   66    59    60    37.50000  110.70000
   66    59    61    37.50000  110.70000
   66    67    68    37.50000  110.70000
   66    67    73    58.35000  112.70000
   66    79    76    58.35000  112.70000
   66    79    80    37.50000  110.70000
   66    79    81    50.00000  109.50000
   66    69    70    37.50000  110.70000
   66    69    71    37.50000  110.70000
   66    69    72    37.50000  110.70000
   67    51    52    37.50000  110.70000
   67    51    53    58.35000  112.70000
   67    73    74    37.50000  110.70000
   67    73    75    37.50000  110.70000
   67    73    76    58.35000  112.70000
   73    67    68    37.50000  110.70000
   73    76    77    37.50000  110.70000
   73    76    78    37.50000  110.70000
   73    76    79    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    37.50000  110.70000
   76    73    75    37.50000  110.70000
   76    79    80    37.50000  110.70000
   76    79    81    50.00000  109.50000
   78    76    77    33.00000  107.80000
   79    66    67    58.35000  112.70000
   79    76    77    37.50000  110.70000
   79    76    78    37.50000  110.70000
   79    81    82    55.00000  108.50000
   81    79    80    35.00000  109.50000
   69    66    67    58.35000  112.70000
   69    66    79    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   58    33    34    37.50000  110.70000
   58    33    38    70.00000  112.02700
   58    44    45    65.00000  117.92700
   58    53    54    37.50000  110.70000
   58    53    55    58.35000  112.70000
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    65    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    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    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    58    44   0.56750  1.0 1.0
   29    33    58    44  -0.07550 -1.0 2.0
   29    33    58    44   0.20000  1.0 3.0
   29    33    58    53   0.44750  1.0 1.0
   29    33    58    53  -0.17800 -1.0 2.0
   29    33    58    53   0.20200  1.0 3.0
   29    33    58    62   0.44750  1.0 1.0
   29    33    58    62  -0.17800 -1.0 2.0
   29    33    58    62   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    58    62    63   0.15000  1.0 3.0
   33    58    62    64   0.15000  1.0 3.0
   33    58    62    65   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    58    44   0.15000  1.0 3.0
   34    33    58    53   0.15000  1.0 3.0
   34    33    58    62   0.15000  1.0 3.0
   38    33    58    44   0.31000  1.0 1.0
   38    33    58    44   0.14700 -1.0 2.0
   38    33    58    44   0.07550  1.0 3.0
   38    33    58    53   0.34400  1.0 1.0
   38    33    58    53   0.09450 -1.0 2.0
   38    33    58    53   0.11100  1.0 3.0
   38    33    58    62   0.34400  1.0 1.0
   38    33    58    62   0.09450 -1.0 2.0
   38    33    58    62   0.11100  1.0 3.0
   38    40    42    43   7.00000 -1.0 2.0
   38    40   -42    44   7.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   7.00000 -1.0 2.0
   40    42    44    58   7.00000 -1.0 2.0
   41    40    42    43   7.00000 -1.0 2.0
   41    40    42    44   7.00000 -1.0 2.0
   42    44    45    46   0.00000  1.0 1.0
   42    44    45    47   0.00000  1.0 1.0
   42    44    45    48   0.09850  1.0 1.0
   42    44    45    48   0.15250 -1.0 2.0
   42    44    45    48  -0.50650  1.0 3.0
   42    44   -58    33   0.09850  1.0 1.0
   42    44   -58    33   0.15250 -1.0 2.0
   42    44   -58    33  -0.50650  1.0 3.0
   42    44    58    53   0.09850  1.0 1.0
   42    44    58    53   0.15250 -1.0 2.0
   42    44    58    53  -0.50650  1.0 3.0
   42    44    58    62   0.09850  1.0 1.0
   42    44    58    62   0.15250 -1.0 2.0
   42    44    58    62  -0.50650  1.0 3.0
   43    42    44    45   7.00000 -1.0 2.0
   43    42    44    58   7.00000 -1.0 2.0
   44    45    48    49   0.15000  1.0 3.0
   44    45    48    50   0.15000  1.0 3.0
   44    45    48    51   0.34400  1.0 1.0
   44    45    48    51   0.09450 -1.0 2.0
   44    45    48    51   0.11100  1.0 3.0
   44    58    62    63   0.15000  1.0 3.0
   44    58    62    64   0.15000  1.0 3.0
   44    58    62    65   0.15000  1.0 3.0
   45    44    58    33   0.46850  1.0 1.0
   45    44    58    33   0.08550 -1.0 2.0
   45    44    58    33   0.09800  1.0 3.0
   45    44    58    53   0.46850  1.0 1.0
   45    44    58    53   0.08550 -1.0 2.0
   45    44    58    53   0.09800  1.0 3.0
   45    44    58    62   0.46850  1.0 1.0
   45    44    58    62   0.08550 -1.0 2.0
   45    44    58    62   0.09800  1.0 3.0
   45    48    51    52   0.15000  1.0 3.0
   45    48   -51    53   0.56750  1.0 1.0
   45    48   -51    53  -0.07550 -1.0 2.0
   45    48   -51    53   0.20000  1.0 3.0
   45    48    51    67   0.56750  1.0 1.0
   45    48    51    67  -0.07550 -1.0 2.0
   45    48    51    67   0.20000  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    51   0.15000  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50   0.15000  1.0 3.0
   47    45    48    51   0.15000  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51    53    55   0.56750  1.0 1.0
   48    51    53    55  -0.07550 -1.0 2.0
   48    51    53    55   0.20000  1.0 3.0
   48    51    53    58   0.56750  1.0 1.0
   48    51    53    58  -0.07550 -1.0 2.0
   48    51    53    58   0.20000  1.0 3.0
   48    51    67    66   0.56750  1.0 1.0
   48    51    67    66  -0.07550 -1.0 2.0
   48    51    67    66   0.20000  1.0 3.0
   48    51    67    68   0.15000  1.0 3.0
   48    51    67    73   0.56750  1.0 1.0
   48    51    67    73  -0.07550 -1.0 2.0
   48    51    67    73   0.20000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    67   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   50    48    51    67   0.15000  1.0 3.0
   51    53    55    56   0.15000  1.0 3.0
   51    53    55    57   0.15000  1.0 3.0
   51    53    55    59   0.56750  1.0 1.0
   51    53    55    59  -0.07550 -1.0 2.0
   51    53    55    59   0.20000  1.0 3.0
   51    53    58    33   0.56750  1.0 1.0
   51    53    58    33  -0.07550 -1.0 2.0
   51    53    58    33   0.20000  1.0 3.0
   51    53   -58    44   0.34400  1.0 1.0
   51    53   -58    44   0.09450 -1.0 2.0
   51    53   -58    44   0.11100  1.0 3.0
   51    53    58    62   0.56750  1.0 1.0
   51    53    58    62  -0.07550 -1.0 2.0
   51    53    58    62   0.20000  1.0 3.0
   51    67    73    74   0.15000  1.0 3.0
   51    67    73    75   0.15000  1.0 3.0
   51    67    73    76   0.56750  1.0 1.0
   51    67    73    76  -0.07550 -1.0 2.0
   51    67    73    76   0.20000  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    58   0.15000  1.0 3.0
   52    51    67    66   0.15000  1.0 3.0
   52    51    67    68   0.15000  1.0 3.0
   52    51    67    73   0.15000  1.0 3.0
   53    51    67    66   0.56750  1.0 1.0
   53    51    67    66  -0.07550 -1.0 2.0
   53    51    67    66   0.20000  1.0 3.0
   53    51    67    68   0.15000  1.0 3.0
   53    51    67    73   0.56750  1.0 1.0
   53    51    67    73  -0.07550 -1.0 2.0
   53    51    67    73   0.20000  1.0 3.0
   53    55    59    60   0.15000  1.0 3.0
   53    55    59    61   0.15000  1.0 3.0
   53    55   -59    66   0.56750  1.0 1.0
   53    55   -59    66  -0.07550 -1.0 2.0
   53    55   -59    66   0.20000  1.0 3.0
   53    58    62    63   0.15000  1.0 3.0
   53    58    62    64   0.15000  1.0 3.0
   53    58    62    65   0.15000  1.0 3.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    59   0.15000  1.0 3.0
   54    53    58    33   0.15000  1.0 3.0
   54    53    58    44   0.15000  1.0 3.0
   54    53    58    62   0.15000  1.0 3.0
   55    53    58    33   0.56750  1.0 1.0
   55    53    58    33  -0.07550 -1.0 2.0
   55    53    58    33   0.20000  1.0 3.0
   55    53    58    44   0.34400  1.0 1.0
   55    53    58    44   0.09450 -1.0 2.0
   55    53    58    44   0.11100  1.0 3.0
   55    53    58    62   0.56750  1.0 1.0
   55    53    58    62  -0.07550 -1.0 2.0
   55    53    58    62   0.20000  1.0 3.0
   55    59    66    67   0.56750  1.0 1.0
   55    59    66    67  -0.07550 -1.0 2.0
   55    59    66    67   0.20000  1.0 3.0
   55    59    66    79   0.56750  1.0 1.0
   55    59    66    79  -0.07550 -1.0 2.0
   55    59    66    79   0.20000  1.0 3.0
   55    59    66    69   0.56750  1.0 1.0
   55    59    66    69  -0.07550 -1.0 2.0
   55    59    66    69   0.20000  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    61   0.15000  1.0 3.0
   56    55    59    66   0.15000  1.0 3.0
   57    55    59    60   0.15000  1.0 3.0
   57    55    59    61   0.15000  1.0 3.0
   57    55    59    66   0.15000  1.0 3.0
   59    66   -67    51   0.56750  1.0 1.0
   59    66   -67    51  -0.07550 -1.0 2.0
   59    66   -67    51   0.20000  1.0 3.0
   59    66    67    68   0.15000  1.0 3.0
   59    66    67    73   0.56750  1.0 1.0
   59    66    67    73  -0.07550 -1.0 2.0
   59    66    67    73   0.20000  1.0 3.0
   59    66    79    76   0.56750  1.0 1.0
   59    66    79    76  -0.07550 -1.0 2.0
   59    66    79    76   0.20000  1.0 3.0
   59    66    79    80   0.15000  1.0 3.0
   59    66    79    81   0.86500  1.0 1.0
   59    66    79    81  -0.17500 -1.0 2.0
   59    66    79    81   0.20800  1.0 3.0
   59    66    69    70   0.15000  1.0 3.0
   59    66    69    71   0.15000  1.0 3.0
   59    66    69    72   0.15000  1.0 3.0
   60    59    66    67   0.15000  1.0 3.0
   60    59    66    79   0.15000  1.0 3.0
   60    59    66    69   0.15000  1.0 3.0
   61    59    66    67   0.15000  1.0 3.0
   61    59    66    79   0.15000  1.0 3.0
   61    59    66    69   0.15000  1.0 3.0
   66    67    73    74   0.15000  1.0 3.0
   66    67    73    75   0.15000  1.0 3.0
   66    67   -73    76   0.56750  1.0 1.0
   66    67   -73    76  -0.07550 -1.0 2.0
   66    67   -73    76   0.20000  1.0 3.0
   66    79    81    82  -0.11600  1.0 1.0
   66    79    81    82  -0.09450 -1.0 2.0
   66    79    81    82   0.21250  1.0 3.0
   67    51    53    54   0.15000  1.0 3.0
   67    51   -53    55   0.56750  1.0 1.0
   67    51   -53    55  -0.07550 -1.0 2.0
   67    51   -53    55   0.20000  1.0 3.0
   67    51    53    58   0.56750  1.0 1.0
   67    51    53    58  -0.07550 -1.0 2.0
   67    51    53    58   0.20000  1.0 3.0
   67    66   -79    76   0.56750  1.0 1.0
   67    66   -79    76  -0.07550 -1.0 2.0
   67    66   -79    76   0.20000  1.0 3.0
   67    66    79    80   0.15000  1.0 3.0
   67    66    79    81   0.86500  1.0 1.0
   67    66    79    81  -0.17500 -1.0 2.0
   67    66    79    81   0.20800  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   67    66    69    71   0.15000  1.0 3.0
   67    66    69    72   0.15000  1.0 3.0
   67    73    76    77   0.15000  1.0 3.0
   67    73    76    78   0.15000  1.0 3.0
   67    73   -76    79   0.56750  1.0 1.0
   67    73   -76    79  -0.07550 -1.0 2.0
   67    73   -76    79   0.20000  1.0 3.0
   68    67    73    74   0.15000  1.0 3.0
   68    67    73    75   0.15000  1.0 3.0
   68    67    73    76   0.15000  1.0 3.0
   73    76   -79    66   0.56750  1.0 1.0
   73    76   -79    66  -0.07550 -1.0 2.0
   73    76   -79    66   0.20000  1.0 3.0
   73    76    79    80   0.15000  1.0 3.0
   73    76    79    81   0.86500  1.0 1.0
   73    76    79    81  -0.17500 -1.0 2.0
   73    76    79    81   0.20800  1.0 3.0
   74    73    76    77   0.15000  1.0 3.0
   74    73    76    78   0.15000  1.0 3.0
   74    73    76    79   0.15000  1.0 3.0
   75    73    76    77   0.15000  1.0 3.0
   75    73    76    78   0.15000  1.0 3.0
   75    73    76    79   0.15000  1.0 3.0
   76    79    81    82  -0.11600  1.0 1.0
   76    79    81    82  -0.09450 -1.0 2.0
   76    79    81    82   0.21250  1.0 3.0
   77    76    79    66   0.15000  1.0 3.0
   77    76    79    80   0.15000  1.0 3.0
   77    76    79    81   0.23400  1.0 3.0
   78    76    79    66   0.15000  1.0 3.0
   78    76    79    80   0.15000  1.0 3.0
   78    76    79    81   0.23400  1.0 3.0
   79    66    67    51   0.56750  1.0 1.0
   79    66    67    51  -0.07550 -1.0 2.0
   79    66    67    51   0.20000  1.0 3.0
   79    66    67    68   0.15000  1.0 3.0
   79    66   -67    73   0.56750  1.0 1.0
   79    66   -67    73  -0.07550 -1.0 2.0
   79    66   -67    73   0.20000  1.0 3.0
   79    66    69    70   0.15000  1.0 3.0
   79    66    69    71   0.15000  1.0 3.0
   79    66    69    72   0.15000  1.0 3.0
   80    79    81    82   0.19450  1.0 3.0
   69    66    67    51   0.56750  1.0 1.0
   69    66    67    51  -0.07550 -1.0 2.0
   69    66    67    51   0.20000  1.0 3.0
   69    66    67    68   0.15000  1.0 3.0
   69    66    67    73   0.56750  1.0 1.0
   69    66    67    73  -0.07550 -1.0 2.0
   69    66    67    73   0.20000  1.0 3.0
   69    66    79    76   0.56750  1.0 1.0
   69    66    79    76  -0.07550 -1.0 2.0
   69    66    79    76   0.20000  1.0 3.0
   69    66    79    80   0.15000  1.0 3.0
   69    66    79    81   0.86500  1.0 1.0
   69    66    79    81  -0.17500 -1.0 2.0
   69    66    79    81   0.20800  1.0 3.0
   58    33    38    39   0.00000  1.0 1.0
   58    33   -38    40   0.09850  1.0 1.0
   58    33   -38    40   0.15250 -1.0 2.0
   58    33   -38    40  -0.50650  1.0 3.0
   58    44    45    46   0.34800  1.0 3.0
   58    44    45    47   0.34800  1.0 3.0
   58    44   -45    48   0.46850  1.0 1.0
   58    44   -45    48   0.08550 -1.0 2.0
   58    44   -45    48   0.09800  1.0 3.0
   58    53    55    56   0.15000  1.0 3.0
   58    53    55    57   0.15000  1.0 3.0
   58    53    55    59   0.56750  1.0 1.0
   58    53    55    59  -0.07550 -1.0 2.0
   58    53    55    59   0.20000  1.0 3.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   45    58    44    42   1.10000 -1.0 2.0
END
