* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    126    211     374
    1     0 S   NP   _N1_     1    29.77017    97.61772   -19.61253
    2     1 S   H    _HN1     2     1.02957   108.83327  -130.03143
    3     1 S   H    _H1_     3     1.02749    16.26686   141.26942
    4     1 S   H    _H2_     4     1.03183   120.48887   104.63133
    5     1 S   CT   _CA1     5     1.50123    96.30219   -14.99587
    6     5 S   HC   _HA1     6     1.09507   105.27331    73.76619
    7     5 S   CO3  _C1_     7     1.53803   112.74787   -46.39016
    8     7 S   O2Z  _O11     8     1.26360   115.27544   -42.67675
    9     7 S   O2Z  _O12     9     1.26307   114.91359   136.34337
   10     5 S   CT   _CB1    10     1.52902   107.06429  -167.84008
   11    10 S   HC   HB11    11     1.09720   109.33440   -43.45889
   12    10 S   HC   HB12    12     1.09836   110.15323    72.68423
   13    10 S   CT   _CG1    13     1.53074   113.34221  -164.59653
   14    13 S   HC   HG11    14     1.09508   111.19419   -51.76119
   15    13 S   HC   HG12    15     1.09517   110.77802    67.70348
   16    13 S   C    _CD1    16     1.51531   110.40025  -171.18354
   17    16 S   O    _OE1    17     1.22886   121.68415   110.98528
   18    16 S   N    _N2_    18     1.38463   113.31236   -67.43106
   19    18 S   H    _HN2    19     1.01533   119.36715    -4.53082
   20    18 S   CT1  _CA2    20     1.45998   122.22901   172.95221
   21    20 S   HC   _HA2    21     1.09702   108.52446    35.42395
   22    20 S   C    _C2_    22     1.53418   109.11118   -81.19564
   23    22 S   O    _O2_    23     1.23117   121.13464   155.59460
   24    20 S   CT   _CB2    32     1.53291   112.52399   158.86419
   25    24 S   HC   HB21    33     1.09385   109.72942    59.45422
   26    24 S   HC   HB22    34     1.09418   109.02858   177.28408
   27    22 S   N    _N3_    24     1.38296   114.42358   -31.76000
   28    27 S   H    _HN3    25     1.01529   119.42998     4.65980
   29    24 S   S    _SG2    35     1.82995   111.44327   -61.82328
   30    27 S   CT   _CA3    26     1.45239   123.31887  -177.31125
   31    30 S   HC   HA31    27     1.09553   108.04278   -50.67863
   32    30 S   HC   HA32    28     1.09552   107.38703    65.69861
   33    29 S   CT   _C23    36     1.88092   101.29115  -174.13876
   34    33 S   OM   _O38    37     1.31828   109.81777   177.26133
   35    30 S   CO3  _C3_    29     1.53036   114.22286  -172.60150
   36    35 S   O2Z  _O31    30     1.26382   116.21769     5.71412
   37    35 S   O2Z  _O32    31     1.26437   114.36274  -174.40280
   38    33 S   CO4  _C22    38     1.54900   102.80326    65.01099
   39    38 S   O    _O37    39     1.23580   122.95061    51.23370
   40    33 S   CM   _C14    51     1.55242   114.45839   -58.43564
   41    38 S   CM   _C17    40     1.49025   117.73294  -128.71876
   42    40 S   CM   _C12    52     1.37190   124.54289   -26.29555
   43    41 S   CM   _C18    41     1.34201   117.95844   163.17732
   44    43 S   HC   _H5_    42     1.08420   123.37711    -6.23939
   45    42 S   CO4  _C13    53     1.50017   122.09453   -30.26244
   46    45 S   O    _O34    54     1.22536   123.61954   -26.33004
   47    43 S   CO4  _C19    43     1.48341   119.92415   170.29580
   48    47 S   O    _O36    44     1.22589   121.30893   172.62698
   49    45 S   CA   _C8_    55     1.47737   117.62201   158.18981
   50    47 S   CM   _C20    45     1.48212   117.33645   -10.15435
   51    50 S   HC   _H6_    46     1.08360   117.63794  -169.70081
   52    49 S   CA   _C9_    56     1.38921   120.26531    26.31026
   53    50 S   CM   _C21    47     1.33938   120.43783    10.19810
   54    52 S   CA   _C4_    57     1.40481   120.86198   176.88970
   55    54 S   HA   _H3_    58     1.09184   118.71481   179.76761
   56    52 S   CO4  _C10    66     1.46722   119.65116    -2.65210
   57    56 S   O    _O33    67     1.21991   123.28563   155.77579
   58    41 S   CM   _C16    48     1.45551   119.82131   -23.23751
   59    54 S   CA   _C5_    59     1.41136   122.71913     0.41965
   60    59 S   OM   _O42    60     1.27641   122.70128   178.99848
   61    42 S   CO4  _C11    68     1.50151   120.51957   147.39082
   62    61 S   O    _O40    69     1.22212   126.49345   -14.47215
   63    53 S   OH   _O35    70     1.38277   119.22304  -179.51061
   64    63 S   HO   _H7_    71     0.97548   107.66516  -176.48197
   65    58 S   CMA  _C15    49     1.36179   119.82664    20.76965
   66    65 S   OM   _O39    50     1.26917   129.42078  -166.41813
   67    59 S   CA   _C6_    61     1.41205   114.60804    -0.78981
   68    67 S   HA   _H4_    62     1.09166   118.96157  -179.44928
   69    49 S   CA   _C7_    63     1.39362   121.42559  -157.23979
   70    69 S   OH   _O41    64     1.36922   123.23925     3.45156
   71    70 S   HO   _H8_    65     0.97453   108.96288    -5.60941
  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
  12   6   2   1   1  10   4  12  10  12   8   4  11   4   6   3
  12   6   3  11   5   9   4   5   2   4   5   3   2   1   2   1
   1   1   4   2   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    65    40    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    43    58    65    66    40    42    45    61  
   38    39    41    65    40    42  
   36    37  
   37  
    0  
   39    41    43    44    47    53    58    65    40    42  
   41    43    58    40  
   42    45    46    49    56    61    62    41    53    58    65    66  
   43    44    47    48    50    53    58    65    66    63  
   45    46    49    52    69    56    57    61    62    58    65    66  
   44    47    48    50    51    53    58    65  
   47    48    50    58  
   46    49    52    54    67    69    70    56    61    62    65  
   49    52    69    61  
   48    50    51    53    58    63  
   50    51    53  
   52    54    55    59    67    68    69    70    71    56    57    61  
   51    53    58    65    63    64  
   53    58    63  
   54    55    59    60    67    69    70    56    57    61    62  
   58    65    66    63    64  
   55    59    60    67    68    69    56    57    61  
   59    60    67    56  
   57    61    62    59    69  
   61    62  
   65    66    63    64  
   60    67    68    69    70  
   67    68    69  
   62    65  
    0  
   64    65  
    0  
   66  
    0  
   68    69    70    71  
   69    70  
   70    71  
   71  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.7500   0.1050   0.470000   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   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   61   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   63   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   66   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   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    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   570.000  1.307
   33    38   317.000  1.522
   33    40   317.000  1.510
   38    39   570.000  1.229
   38    41   320.000  1.462
   41    43   549.000  1.340
   41    58   380.000  1.444
   43    44   340.000  1.080
   43    47   320.000  1.462
   47    48   570.000  1.229
   47    50   320.000  1.462
   50    51   340.000  1.080
   50    53   549.000  1.340
   53    58   380.000  1.444
   53    63   510.000  1.338
   58    65   465.000  1.376
   65    66   745.000  1.250
   65    40   465.000  1.376
   40    42   549.000  1.340
   42    45   320.000  1.462
   42    61   320.000  1.462
   45    46   570.000  1.229
   45    49   310.000  1.470
   49    52   469.000  1.400
   49    69   469.000  1.400
   52    54   469.000  1.400
   52    56   310.000  1.470
   54    55   367.000  1.080
   54    59   469.000  1.400
   59    60   450.000  1.364
   59    67   469.000  1.400
   67    68   367.000  1.080
   67    69   469.000  1.400
   69    70   450.000  1.364
   70    71   553.000  0.945
   56    57   570.000  1.229
   56    61   250.000  1.523
   61    62   570.000  1.229
   63    64   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    85.00000  114.68000
   29    33    38    75.00000  110.18000
   29    33    40    75.00000  112.20000
   33    38    39    80.00000  120.40000
   33    38    41    65.00000  118.62400
   33    40    65    70.00000  124.00000
   33    40    42    70.00000  124.00000
   38    33    34    90.00000  108.74100
   38    41    43    65.00000  118.96000
   38    41    58    65.00000  118.96000
   41    38    39    80.00000  123.72100
   41    43    44    35.00000  120.00000
   41    43    47    65.00000  118.96000
   41    58    53    70.00000  123.01800
   41    58    65    70.00000  117.34000
   43    47    48    80.00000  123.72100
   43    47    50    65.00000  118.65900
   47    43    44    40.00000  117.72500
   47    50    51    40.00000  117.72500
   47    50    53    65.00000  118.96000
   50    47    48    80.00000  123.72100
   50    53    58    70.00000  123.01800
   50    53    63    80.00000  121.38400
   53    50    51    35.00000  120.00000
   53    58    65    70.00000  117.34000
   53    63    64    70.00000  107.45700
   58    41    43    70.00000  123.01800
   58    65    66    65.00000  137.10300
   58    65    40    70.00000  123.01800
   65    40    42    70.00000  117.34000
   40    33    34    85.00000  110.90400
   40    33    38    70.00000  109.06800
   40    65    66    65.00000  137.10300
   40    42    45    65.00000  118.96000
   40    42    61    65.00000  118.96000
   42    45    46    80.00000  123.72100
   42    45    49    65.00000  117.02400
   42    61    56    65.00000  116.00000
   42    61    62    80.00000  123.72100
   45    49    52    60.00000  119.52600
   45    49    69    60.00000  119.52600
   49    45    46    75.00000  123.78400
   49    52    54    63.00000  120.00000
   49    52    56    60.00000  119.52600
   49    69    67    63.00000  120.00000
   49    69    70    70.00000  120.00000
   52    54    55    35.00000  120.00000
   52    54    59    63.00000  120.00000
   52    56    57    75.00000  123.78400
   52    56    61    60.00000  117.28700
   54    59    60    70.00000  120.00000
   54    59    67    63.00000  120.00000
   59    54    55    35.00000  120.00000
   59    67    68    35.00000  120.00000
   59    67    69    63.00000  120.00000
   67    59    60    70.00000  120.00000
   67    69    70    70.00000  120.00000
   69    49    52    63.00000  120.00000
   69    67    68    35.00000  120.00000
   69    70    71    35.00000  113.00000
   56    52    54    60.00000  119.52600
   56    61    62    80.00000  119.30300
   61    42    45    65.00000  115.30000
   61    56    57    80.00000  119.30300
   63    53    58    80.00000  121.38400
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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   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    39   0.30150 -1.0 2.0
   29    33    38    41   0.65300  1.0 1.0
   29    33    38    41  -0.03850 -1.0 2.0
   29    33    38    41   0.33900  1.0 3.0
   29    33    40    65   0.42700  1.0 1.0
   29    33    40    65  -0.70350 -1.0 2.0
   29    33    40    65  -0.43150  1.0 3.0
   29    33    40    42   0.42700  1.0 1.0
   29    33    40    42  -0.70350 -1.0 2.0
   29    33    40    42  -0.43150  1.0 3.0
   33    38    41    43  -0.33500  1.0 1.0
   33    38    41    43   1.06600 -1.0 2.0
   33    38    41    43  -0.14000  1.0 3.0
   33    38    41    58  -0.33500  1.0 1.0
   33    38    41    58   1.06600 -1.0 2.0
   33    38    41    58  -0.14000  1.0 3.0
   33    40    42    45   7.00000 -1.0 2.0
   33    40    42    61   7.00000 -1.0 2.0
   34    33    38    39   0.30150 -1.0 2.0
   34    33    38    41   0.65300  1.0 1.0
   34    33    38    41  -0.03850 -1.0 2.0
   34    33    38    41   0.33900  1.0 3.0
   34    33    40    65   0.39000  1.0 1.0
   34    33    40    65  -0.05800 -1.0 2.0
   34    33    40    65  -0.55150  1.0 3.0
   34    33    40    42   0.39000  1.0 1.0
   34    33    40    42  -0.05800 -1.0 2.0
   34    33    40    42  -0.55150  1.0 3.0
   38    33    40    65  -0.51250  1.0 1.0
   38    33    40    65  -0.88800 -1.0 2.0
   38    33    40    65   0.08850  1.0 3.0
   38    33    40    42  -0.51250  1.0 1.0
   38    33    40    42  -0.88800 -1.0 2.0
   38    33    40    42   0.08850  1.0 3.0
   38    41    43    44   7.00000 -1.0 2.0
   38    41    43    47   7.00000 -1.0 2.0
   38    41    58    53  -0.18600  1.0 3.0
   38    41   -58    65  -0.18600  1.0 3.0
   39    38    41    43   1.00000 -1.0 2.0
   39    38    41    58   1.00000 -1.0 2.0
   41    43    47    48   1.00000 -1.0 2.0
   41    43    47    50  -1.18350  1.0 1.0
   41    43    47    50   1.45950 -1.0 2.0
   41    58    65    66   7.00000 -1.0 2.0
   41    58    65    40   7.00000 -1.0 2.0
   43    41    58    53   0.28850  1.0 1.0
   43    41    58    53   2.61350 -1.0 2.0
   43    41    58    53   0.78400  1.0 3.0
   43    41    58    65   0.28850  1.0 1.0
   43    41    58    65   2.61350 -1.0 2.0
   43    41    58    65   0.78400  1.0 3.0
   43    47    50    51   0.93700 -1.0 2.0
   43    47   -50    53  -1.18350  1.0 1.0
   43    47   -50    53   1.45950 -1.0 2.0
   44    43    47    48   0.00000  1.0 1.0
   44    43    47    50   0.93700 -1.0 2.0
   47    50    53    58   7.00000 -1.0 2.0
   47    50    53    63   7.00000 -1.0 2.0
   48    47    50    51   0.00000  1.0 1.0
   48    47    50    53   1.00000 -1.0 2.0
   50    53   -58    41   0.28850  1.0 1.0
   50    53   -58    41   2.61350 -1.0 2.0
   50    53   -58    41   0.78400  1.0 3.0
   50    53    58    65   0.28850  1.0 1.0
   50    53    58    65   2.61350 -1.0 2.0
   50    53    58    65   0.78400  1.0 3.0
   50    53    63    64  -0.66100  1.0 1.0
   50    53    63    64   1.20850 -1.0 2.0
   50    53    63    64  -0.36000  1.0 3.0
   51    50    53    58   7.00000 -1.0 2.0
   51    50    53    63   7.00000 -1.0 2.0
   53    58    65    66   7.00000 -1.0 2.0
   53    58    65    40   7.00000 -1.0 2.0
   58    41    43    44   7.00000 -1.0 2.0
   58    41   -43    47   7.00000 -1.0 2.0
   58    53    63    64  -0.66100  1.0 1.0
   58    53    63    64   1.20850 -1.0 2.0
   58    53    63    64  -0.36000  1.0 3.0
   58    65   -40    33   7.00000 -1.0 2.0
   58    65    40    42   7.00000 -1.0 2.0
   65    40    42    45   7.00000 -1.0 2.0
   65    40    42    61   7.00000 -1.0 2.0
   66    65    40    33   7.00000 -1.0 2.0
   66    65    40    42   7.00000 -1.0 2.0
   40    33    38    39   0.30150 -1.0 2.0
   40    33   -38    41   0.65300  1.0 1.0
   40    33   -38    41  -0.03850 -1.0 2.0
   40    33   -38    41   0.33900  1.0 3.0
   40    42    45    46   1.00000 -1.0 2.0
   40    42    45    49  -1.65800  1.0 1.0
   40    42    45    49   0.77650 -1.0 2.0
   40    42    61    56   0.50400  1.0 1.0
   40    42    61    56   1.60000 -1.0 2.0
   40    42    61    56  -0.01800  1.0 3.0
   40    42    61    62   1.00000 -1.0 2.0
   42    45    49    52  -0.11500  1.0 1.0
   42    45    49    52   1.10450 -1.0 2.0
   42    45    49    52  -0.48050  1.0 3.0
   42    45    49    69  -0.11500  1.0 1.0
   42    45    49    69   1.10450 -1.0 2.0
   42    45    49    69  -0.48050  1.0 3.0
   45    42    61    56   1.50000 -1.0 2.0
   45    42    61    62   2.50000 -1.0 2.0
   45    49    52    54   3.62500 -1.0 2.0
   45    49   -52    56   3.62500 -1.0 2.0
   45    49    69    67   3.62500 -1.0 2.0
   45    49    69    70   3.62500 -1.0 2.0
   46    45    49    52   1.05000 -1.0 2.0
   46    45    49    69   1.05000 -1.0 2.0
   49    52    54    55   3.62500 -1.0 2.0
   49    52    54    59   3.62500 -1.0 2.0
   49    52    56    57   1.05000 -1.0 2.0
   49    52    56    61   0.56600 -1.0 2.0
   49    69    70    71   0.84100 -1.0 2.0
   52    49    69    67   3.62500 -1.0 2.0
   52    49    69    70   3.62500 -1.0 2.0
   52    54    59    60   3.62500 -1.0 2.0
   52    54   -59    67   3.62500 -1.0 2.0
   52    56   -61    42   0.43900  1.0 1.0
   52    56   -61    42  -0.18150 -1.0 2.0
   52    56   -61    42  -0.03650  1.0 3.0
   52    56    61    62   0.03000  1.0 1.0
   52    56    61    62   0.58800 -1.0 2.0
   52    56    61    62   0.15550  1.0 3.0
   54    52    56    57   1.05000 -1.0 2.0
   54    52    56    61   0.56600 -1.0 2.0
   54    59    67    68   3.62500 -1.0 2.0
   54    59    67    69   3.62500 -1.0 2.0
   55    54    59    60   3.62500 -1.0 2.0
   55    54    59    67   3.62500 -1.0 2.0
   59    67   -69    49   3.62500 -1.0 2.0
   59    67    69    70   3.62500 -1.0 2.0
   60    59    67    68   3.62500 -1.0 2.0
   60    59    67    69   3.62500 -1.0 2.0
   67    69    70    71   0.84100 -1.0 2.0
   68    67    69    49   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   69    49   -52    54   3.62500 -1.0 2.0
   69    49    52    56   3.62500 -1.0 2.0
   56    52    54    55   3.62500 -1.0 2.0
   56    52    54    59   3.62500 -1.0 2.0
   57    56    61    42   0.03000  1.0 1.0
   57    56    61    42   0.58800 -1.0 2.0
   57    56    61    42   0.15550  1.0 3.0
   57    56    61    62   0.06100 -1.0 2.0
   61    42    45    46   2.50000 -1.0 2.0
   61    42   -45    49   1.50000 -1.0 2.0
   63    53    58    41   0.50950  1.0 1.0
   63    53    58    41   0.56650 -1.0 2.0
   63    53    58    41   0.34050  1.0 3.0
   63    53    58    65   0.50950  1.0 1.0
   63    53    58    65   0.56650 -1.0 2.0
   63    53    58    65   0.34050  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    41    38    39  10.50000 -1.0 2.0
   38    58    41    43   1.10000 -1.0 2.0
   47    44    43    41   1.10000 -1.0 2.0
   43    50    47    48  10.50000 -1.0 2.0
   47    51    50    53   1.10000 -1.0 2.0
   58    63    53    50   1.10000 -1.0 2.0
   41    53    58    65   1.10000 -1.0 2.0
   40    66    65    58   1.10000 -1.0 2.0
   33    65    40    42   1.10000 -1.0 2.0
   45    61    42    40   1.10000 -1.0 2.0
   42    49    45    46  10.50000 -1.0 2.0
   52    69    49    45   4.00000 -1.0 2.0
   54    56    52    49   4.00000 -1.0 2.0
   59    55    54    52   1.10000 -1.0 2.0
   67    60    59    54   4.00000 -1.0 2.0
   69    68    67    59   1.10000 -1.0 2.0
   67    70    69    49   4.00000 -1.0 2.0
   52    61    56    57  10.50000 -1.0 2.0
   42    56    61    62  10.50000 -1.0 2.0
END
