* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    131    200     377
    1     0 S   NP   _N1_     1    28.74972    96.53362   -23.63167
    2     1 S   H    _HN1     2     1.02828    38.17214   170.30896
    3     1 S   H    _H1_     3     1.02791   108.51998   -94.07059
    4     1 S   H    _H2_     4     1.02948    70.89660     9.55893
    5     1 S   CT   _CA1     5     1.50126   135.86679   109.52103
    6     5 S   HC   _HA1     6     1.09574   105.16840    94.54522
    7     5 S   CO3  _C1_     7     1.53769   112.42946   -25.65313
    8     7 S   O2Z  _O11     8     1.26373   115.01098   -43.25089
    9     7 S   O2Z  _O12     9     1.26234   114.93649   135.74283
   10     5 S   CT   _CB1    10     1.53059   107.39763  -147.51309
   11    10 S   HC   HB11    11     1.09839   109.32014   -49.57453
   12    10 S   HC   HB12    12     1.09811   110.47765    67.01081
   13    10 S   CT   _CG1    13     1.53016   112.64914  -170.52450
   14    13 S   HC   HG11    14     1.09574   110.69997   -66.96674
   15    13 S   HC   HG12    15     1.09670   109.73341    52.28905
   16    13 S   C    _CD1    16     1.51815   112.03141   172.73013
   17    16 S   O    _OE1    17     1.22753   123.20399    10.53913
   18    16 S   N    _N2_    18     1.38650   111.81314  -169.44982
   19    18 S   H    _HN2    19     1.01588   118.99061     1.17736
   20    18 S   CT1  _CA2    20     1.46224   123.35791   176.81974
   21    20 S   HC   _HA2    21     1.09742   109.28096     6.84659
   22    20 S   C    _C2_    22     1.53669   108.95467  -108.65401
   23    22 S   O    _O2_    23     1.23084   122.20042  -149.68680
   24    20 S   CT   _CB2    32     1.53466   111.61185   128.79372
   25    24 S   HC   HB21    33     1.09470   109.57173    56.67292
   26    24 S   HC   HB22    34     1.09405   109.70001   175.46059
   27    22 S   N    _N3_    24     1.38298   113.89111    37.85280
   28    27 S   H    _HN3    25     1.01549   119.61134    -3.36598
   29    24 S   S    _SG2    35     1.83207   111.06956   -64.42569
   30    27 S   CT   _CA3    26     1.45285   123.28721   177.15462
   31    30 S   HC   HA31    27     1.09547   107.51467   -64.68964
   32    30 S   HC   HA32    28     1.09555   107.99540    51.77076
   33    29 S   CT   _C16    36     1.87697   101.77647  -178.37346
   34    30 S   CO3  _C3_    29     1.52978   114.03269   173.75750
   35    34 S   O2Z  _O31    30     1.26385   116.06432    -0.71846
   36    34 S   O2Z  _O32    31     1.26424   114.42148   179.34748
   37    33 S   CM   _C11    37     1.52139   105.83083   -63.30780
   38    37 S   HC   _H29    38     1.08976   117.87749    84.92519
   39    33 S   CO4  _C15    67     1.54103   109.05976    54.13873
   40    39 S   O    _O20    68     1.22601   124.81610  -129.08387
   41    37 S   CMA  _C13    39     1.34908   124.02363   -95.06079
   42    41 S   OM   _O18    40     1.25914   130.66533   179.61437
   43    39 S   OS   _O24    69     1.36795   110.91781    52.80069
   44    41 S   CM   _C10    41     1.46373   117.94672     1.58375
   45    44 S   HC   _H28    42     1.08772   117.13426   163.36779
   46    43 S   CT   _C20    70     1.43031   115.56708   178.12800
   47    46 S   HC   _H36    71     1.09321   108.06146  -179.74283
   48    46 S   HC   _H37    72     1.09410   110.27131    61.55656
   49    46 S   HC   _H38    73     1.09421   110.26524   -61.13329
   50    44 S   CM   _C14    43     1.35039   122.59946   -18.09560
   51    33 S   CT   _C17    44     1.57188   112.81051   176.73517
   52    50 S   OS   _O23    62     1.38167   125.90064  -177.21547
   53    51 S   CO4  _C12    45     1.53417   114.22686   -49.83666
   54    53 S   O    _O19    46     1.21716   129.24025    66.20651
   55    52 S   CT   _C19    63     1.42170   117.98503    -1.24772
   56    55 S   HC   _H33    64     1.09409   107.85121  -179.59749
   57    55 S   HC   _H34    65     1.09478   111.00523    62.48097
   58    55 S   HC   _H35    66     1.09482   111.01303   -61.66336
   59    53 S   CA   _C6_    47     1.43963   107.78782  -115.63115
   60    59 S   CA   _C8_    48     1.37510   105.99237    -1.67725
   61    60 S   CA   _C4_    49     1.38236   120.70673   179.74977
   62    61 S   HA   _H26    50     1.08560   120.44473  -179.43559
   63    51 S   OS   _O21    61     1.47244   108.78896  -164.78530
   64    61 S   CA   _C7_    51     1.40536   118.52894     0.45970
   65    64 S   CA   _C5_    52     1.41253   119.89411    -1.05425
   66    65 S   HA   _H27    53     1.08771   119.90564  -178.90300
   67    64 S   CT   _C18    57     1.50053   120.08849  -178.38190
   68    67 S   HC   _H30    58     1.09429   109.96622    89.64903
   69    67 S   HC   _H31    59     1.09505   110.86937  -149.84262
   70    67 S   HC   _H32    60     1.09508   110.92426   -30.82756
   71    59 S   CA   _C9_    54     1.37822   131.58201   177.93190
   72    71 S   OH   _O22    55     1.36053   122.85232     0.08393
   73    72 S   HO   _H39    56     0.97458   108.35250     0.88867
  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  12   5  11   3   6   3   5   7   3   3   2   1
   1  11   9   6   8   4   3   2   1   1  10   8  10   4   2   8
   8   3   4   2   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    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    50    51    53    63    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    44    50    51    53    54    59    60    63    52    39    40    43    46  
   35    36  
   36  
    0  
   38    41    42    44    45    50    51    53    63    39    40    43  
   41    42    44    51    39  
   40    43    46    47    48    49    41    50    51    53    63  
   43    46    51  
   42    44    45    50    51    52  
   44    45    50  
   46    47    48    49    51  
   45    50    51    53    63    52    55  
   50    51    52  
   47    48    49  
   48    49  
   49  
    0  
   51    53    54    59    60    63    52    55    56    57    58  
   53    54    59    60    61    71    63    52    55  
   55    56    57    58    53    63  
   54    59    60    61    65    71    72    63  
   59    60    71    63  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    64    65    66    71    72    73    63  
   61    62    64    65    71    72    67    63  
   62    64    65    66    71    67    68    69    70    63  
   64    65    67    63  
   64    71  
   65    66    71    72    67    68    69    70  
   66    71    72    73    67    68    69    70  
   71    72    67  
   68    69    70    71  
   69    70  
   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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   48   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0760   0.016000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660   0.317000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   53   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5500   0.0700  -0.115000   2.5000   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   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   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  1.510
   33    51   268.000  1.529
   33    39   317.000  1.522
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    44   465.000  1.376
   44    45   340.000  1.080
   44    50   549.000  1.340
   50    51   317.000  1.510
   50    52   440.000  1.360
   51    53   317.000  1.522
   51    63   320.000  1.410
   53    54   570.000  1.229
   53    59   310.000  1.470
   59    60   469.000  1.400
   59    71   469.000  1.400
   60    61   469.000  1.400
   60    63   450.000  1.364
   61    62   367.000  1.080
   61    64   469.000  1.400
   64    65   469.000  1.400
   64    67   317.000  1.510
   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   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   52    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   39    40   570.000  1.229
   39    43   214.000  1.327
   43    46   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  110.18000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    51    50    70.00000  112.02700
   33    51    53    63.00000  111.10000
   33    51    63    50.00000  109.50000
   33    39    40    80.00000  120.40000
   33    39    43    81.00000  111.40000
   37    41    42    65.00000  137.10300
   37    41    44    70.00000  123.01800
   41    37    38    40.00000  120.50800
   41    44    45    40.00000  120.50800
   41    44    50    70.00000  117.34000
   44    41    42    65.00000  137.10300
   44    50    51    70.00000  124.00000
   44    50    52    80.00000  120.01400
   50    44    45    35.00000  120.00000
   50    51    53    70.00000  109.06800
   50    51    63    85.00000  110.90400
   50    52    55    90.00000  111.18400
   51    33    37    70.00000  112.02700
   51    53    54    80.00000  120.40000
   51    53    59    65.00000  115.47100
   51    63    60    75.00000  111.00000
   53    59    60    60.00000  119.52600
   53    59    71    60.00000  119.52600
   59    53    54    75.00000  123.78400
   59    60    61    63.00000  120.00000
   59    60    63    70.00000  120.00000
   59    71    65    63.00000  120.00000
   59    71    72    70.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    64    63.00000  120.00000
   61    64    65    63.00000  120.00000
   61    64    67    70.00000  120.00000
   64    61    62    35.00000  120.00000
   64    65    66    35.00000  120.00000
   64    65    71    63.00000  120.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    70    35.00000  109.50000
   65    71    72    70.00000  120.00000
   71    59    60    63.00000  120.00000
   71    65    66    35.00000  120.00000
   71    72    73    35.00000  113.00000
   67    64    65    70.00000  120.00000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   63    51    53    90.00000  108.74100
   63    60    61    70.00000  120.00000
   52    50    51    85.00000  112.85300
   52    55    56    35.00000  109.50000
   52    55    57    35.00000  109.50000
   52    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   39    33    37    70.00000  109.06800
   39    33    51    63.00000  111.10000
   39    43    46    83.00000  116.90000
   43    39    40    83.00000  123.40000
   43    46    47    35.00000  109.50000
   43    46    48    35.00000  109.50000
   43    46    49    35.00000  109.50000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    51    50   0.56750  1.0 1.0
   29    33    51    50  -0.07550 -1.0 2.0
   29    33    51    50   0.20000  1.0 3.0
   29    33    51    53   0.56750  1.0 1.0
   29    33    51    53  -0.07550 -1.0 2.0
   29    33    51    53   0.20000  1.0 3.0
   29    33    51    63   0.56750  1.0 1.0
   29    33    51    63  -0.07550 -1.0 2.0
   29    33    51    63   0.20000  1.0 3.0
   29    33    39    40   0.30150 -1.0 2.0
   29    33    39    43   0.40000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    51    53    54   0.30150 -1.0 2.0
   33    51    53    59   0.05850 -1.0 2.0
   33    51    53    59   0.17250  1.0 3.0
   33    51    63    60  -0.32850  1.0 1.0
   33    51    63    60  -0.35800 -1.0 2.0
   33    51    63    60   0.33950  1.0 3.0
   33    39    43    46   1.63150  1.0 1.0
   33    39    43    46   2.92000 -1.0 2.0
   37    33    51    50   0.31000  1.0 1.0
   37    33    51    50   0.14700 -1.0 2.0
   37    33    51    50   0.07550  1.0 3.0
   37    33    51    53  -0.98800  1.0 1.0
   37    33    51    53   0.48800 -1.0 2.0
   37    33    51    53   0.76800  1.0 3.0
   37    33    51    63   0.61850  1.0 1.0
   37    33    51    63  -0.22750 -1.0 2.0
   37    33    51    63   0.15300  1.0 3.0
   37    33    39    40   0.30150 -1.0 2.0
   37    33    39    43   0.40000  1.0 3.0
   37    41    44    45   7.00000 -1.0 2.0
   37    41   -44    50   7.00000 -1.0 2.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    44   7.00000 -1.0 2.0
   41    44    50    51   7.00000 -1.0 2.0
   41    44    50    52   7.00000 -1.0 2.0
   42    41    44    45   7.00000 -1.0 2.0
   42    41    44    50   7.00000 -1.0 2.0
   44    50   -51    33   0.09850  1.0 1.0
   44    50   -51    33   0.15250 -1.0 2.0
   44    50   -51    33  -0.50650  1.0 3.0
   44    50    51    53  -0.51250  1.0 1.0
   44    50    51    53  -0.88800 -1.0 2.0
   44    50    51    53   0.08850  1.0 3.0
   44    50    51    63   0.39000  1.0 1.0
   44    50    51    63  -0.05800 -1.0 2.0
   44    50    51    63  -0.55150  1.0 3.0
   44    50    52    55  -2.26850  1.0 1.0
   44    50    52    55   3.39050 -1.0 2.0
   45    44    50    51   7.00000 -1.0 2.0
   45    44    50    52   7.00000 -1.0 2.0
   50    51    53    54   0.30150 -1.0 2.0
   50    51    53    59   0.65300  1.0 1.0
   50    51    53    59  -0.03850 -1.0 2.0
   50    51    53    59   0.33900  1.0 3.0
   50    51    63    60  -0.25600  1.0 1.0
   50    51    63    60  -0.40050 -1.0 2.0
   50    51    63    60   0.34700  1.0 3.0
   50    52    55    56   0.08050  1.0 3.0
   50    52    55    57   0.08050  1.0 3.0
   50    52    55    58   0.08050  1.0 3.0
   51    33    37    38   0.00000  1.0 1.0
   51    33   -37    41   0.09850  1.0 1.0
   51    33   -37    41   0.15250 -1.0 2.0
   51    33   -37    41  -0.50650  1.0 3.0
   51    33    39    40   0.30150 -1.0 2.0
   51    33    39    43   0.36750  1.0 3.0
   51    50    52    55   2.00000 -1.0 2.0
   51    53   -59    60   2.26350  1.0 1.0
   51    53   -59    60   0.76750 -1.0 2.0
   51    53   -59    60   0.22500  1.0 3.0
   51    53    59    71   2.26350  1.0 1.0
   51    53    59    71   0.76750 -1.0 2.0
   51    53    59    71   0.22500  1.0 3.0
   53    51   -63    60  -0.25600  1.0 1.0
   53    51   -63    60  -0.40050 -1.0 2.0
   53    51   -63    60   0.34700  1.0 3.0
   53    59    60    61   3.62500 -1.0 2.0
   53    59   -60    63   3.62500 -1.0 2.0
   53    59    71    65   3.62500 -1.0 2.0
   53    59    71    72   3.62500 -1.0 2.0
   54    53    59    60   1.05000 -1.0 2.0
   54    53    59    71   1.05000 -1.0 2.0
   59    60    61    62   3.62500 -1.0 2.0
   59    60    61    64   3.62500 -1.0 2.0
   59    60   -63    51   1.63200 -1.0 2.0
   59    71    72    73   0.84100 -1.0 2.0
   60    59    71    65   3.62500 -1.0 2.0
   60    59    71    72   3.62500 -1.0 2.0
   60    61   -64    65   3.62500 -1.0 2.0
   60    61    64    67   3.62500 -1.0 2.0
   61    60    63    51   1.63200 -1.0 2.0
   61    64    65    66   3.62500 -1.0 2.0
   61    64    65    71   3.62500 -1.0 2.0
   61    64    67    68   0.00000  1.0 1.0
   61    64    67    69   0.00000  1.0 1.0
   61    64    67    70   0.00000  1.0 1.0
   62    61    64    65   3.62500 -1.0 2.0
   62    61    64    67   3.62500 -1.0 2.0
   64    65   -71    59   3.62500 -1.0 2.0
   64    65    71    72   3.62500 -1.0 2.0
   65    64    67    68   0.00000  1.0 1.0
   65    64    67    69   0.00000  1.0 1.0
   65    64    67    70   0.00000  1.0 1.0
   65    71    72    73   0.84100 -1.0 2.0
   66    65    71    59   3.62500 -1.0 2.0
   66    65    71    72   3.62500 -1.0 2.0
   71    59   -60    61   3.62500 -1.0 2.0
   71    59    60    63   3.62500 -1.0 2.0
   67    64    65    66   3.62500 -1.0 2.0
   67    64    65    71   3.62500 -1.0 2.0
   63    51    53    54   0.30150 -1.0 2.0
   63    51   -53    59   0.65300  1.0 1.0
   63    51   -53    59  -0.03850 -1.0 2.0
   63    51   -53    59   0.33900  1.0 3.0
   63    60    61    62   3.62500 -1.0 2.0
   63    60    61    64   3.62500 -1.0 2.0
   52    50    51    33   0.09700  1.0 1.0
   52    50    51    33   0.15600 -1.0 2.0
   52    50    51    33  -0.50800  1.0 3.0
   52    50    51    53   0.09700  1.0 1.0
   52    50    51    53   0.15600 -1.0 2.0
   52    50    51    53  -0.50800  1.0 3.0
   52    50    51    63   0.09700  1.0 1.0
   52    50    51    63   0.15600 -1.0 2.0
   52    50    51    63  -0.50800  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.51250  1.0 1.0
   39    33    37    41  -0.88800 -1.0 2.0
   39    33    37    41   0.08850  1.0 3.0
   39    33    51    50  -0.98800  1.0 1.0
   39    33    51    50   0.48800 -1.0 2.0
   39    33    51    50   0.76800  1.0 3.0
   39    33    51    53   0.11950  1.0 1.0
   39    33    51    53   0.20300 -1.0 2.0
   39    33    51    53  -0.70800  1.0 3.0
   39    33    51    63  -0.09450  1.0 1.0
   39    33    51    63  -1.12950 -1.0 2.0
   39    33    51    63   0.54000  1.0 3.0
   39    43    46    47   0.08050  1.0 3.0
   39    43    46    48   0.08050  1.0 3.0
   39    43    46    49   0.08050  1.0 3.0
   40    39    43    46   3.00000 -1.0 2.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   44    42    41    37   1.10000 -1.0 2.0
   41    45    44    50   1.10000 -1.0 2.0
   51    52    50    44   1.10000 -1.0 2.0
   51    59    53    54  10.50000 -1.0 2.0
   60    71    59    53   4.00000 -1.0 2.0
   61    63    60    59   4.00000 -1.0 2.0
   64    62    61    60   1.10000 -1.0 2.0
   65    67    64    61   4.00000 -1.0 2.0
   71    66    65    64   1.10000 -1.0 2.0
   65    72    71    59   4.00000 -1.0 2.0
   33    43    39    40  10.50000 -1.0 2.0
END
