* LIGAND DATABASE FILE (OPLS2005)
*
001      76    76    140    203     398
    1     0 S   NP   _N1_     1    29.21664    97.92105   -22.59317
    2     1 S   H    _HN1     2     1.02787   105.29845  -106.64440
    3     1 S   H    _H1_     3     1.02948    67.93651    -2.66168
    4     1 S   H    _H2_     4     1.02828    42.38555   153.41601
    5     1 S   CT   _CA1     5     1.50084   140.24997    93.15191
    6     5 S   HC   _HA1     6     1.09578   105.20168    97.92831
    7     5 S   CO3  _C1_     7     1.53795   112.54533   -22.27085
    8     7 S   O2Z  _O11     8     1.26364   115.01180   -42.28947
    9     7 S   O2Z  _O12     9     1.26249   114.94502   136.93455
   10     5 S   CT   _CB1    10     1.53094   107.43717  -144.12969
   11    10 S   HC   HB11    11     1.09828   109.38273   -50.64768
   12    10 S   HC   HB12    12     1.09810   110.46512    66.00670
   13    10 S   CT   _CG1    13     1.52922   112.48246  -171.64786
   14    13 S   HC   HG11    14     1.09546   110.44884   -66.64500
   15    13 S   HC   HG12    15     1.09669   109.78527    52.60460
   16    13 S   C    _CD1    16     1.51704   112.41681   173.35754
   17    16 S   O    _OE1    17     1.22719   123.27977     9.51099
   18    16 S   N    _N2_    18     1.38653   111.60555  -170.71101
   19    18 S   H    _HN2    19     1.01581   119.01190     2.14448
   20    18 S   CT1  _CA2    20     1.46282   123.45020   178.36721
   21    20 S   HC   _HA2    21     1.09718   109.27824     8.62275
   22    20 S   C    _C2_    22     1.53759   109.50573  -107.31547
   23    22 S   O    _O2_    23     1.23102   122.00482  -154.98038
   24    20 S   CT   _CB2    32     1.53509   111.11666   130.60349
   25    24 S   HC   HB21    33     1.09216   108.55972    57.56620
   26    24 S   HC   HB22    34     1.09423   110.12424   175.91026
   27    22 S   N    _N3_    24     1.38208   114.18746    32.11080
   28    27 S   H    _HN3    25     1.01525   119.51413    -2.52018
   29    24 S   S    _SG2    35     1.83127   111.16817   -64.34116
   30    27 S   CT   _CA3    26     1.45307   123.48979   176.60489
   31    30 S   HC   HA31    27     1.09530   107.23226   -75.64341
   32    30 S   HC   HA32    28     1.09530   108.51986    40.89859
   33    29 S   CT   _C9_    36     1.87216   102.63949   163.08884
   34    30 S   CO3  _C3_    29     1.52983   113.84791   163.68056
   35    34 S   O2Z  _O31    30     1.26386   116.02161     9.76879
   36    34 S   O2Z  _O32    31     1.26414   114.45276  -170.25708
   37    33 S   CM   _C11    37     1.51545   107.59146    64.78972
   38    37 S   HC   _H15    38     1.08964   118.82479   -51.99758
   39    33 S   CT   _C10    42     1.54236   104.43015  -175.72295
   40    39 S   HC   _H12    43     1.09672   112.14475    56.24202
   41    39 S   HC   _H13    44     1.09712   112.04921   -64.47686
   42    39 S   HC   _H14    45     1.09618   111.31778   175.38297
   43    33 S   CT   _C8_    46     1.55176   112.90726   -55.96861
   44    43 S   HC   _H10    47     1.10027   108.57670   179.56659
   45    43 S   HC   _H11    48     1.09700   110.15841    66.02716
   46    37 S   CMA  _C12    39     1.50727   123.49012   137.56470
   47    46 S   OM   _O33    40     1.26179   120.84208    71.99718
   48    46 S   OM   _O34    41     1.26146   119.96277  -110.06721
   49    43 S   CT   _C7_    49     1.54000   116.04888   -59.71830
   50    49 S   HC   _H8_    50     1.09201   110.10929    42.22867
   51    49 S   HC   _H9_    51     1.09587   109.32544   -75.98077
   52    49 S   CM   _C6_    52     1.50568   110.86820   164.37138
   53    52 S   HC   _H7_    53     1.08940   115.00856    35.55634
   54    52 S   CM   _C5_    54     1.34791   126.82021  -142.10968
   55    54 S   CT   _C4_    55     1.50422   124.25098    -5.65856
   56    55 S   HC   _H4_    56     1.09378   110.37242   106.08841
   57    55 S   HC   _H5_    57     1.09306   113.08883   -15.30665
   58    55 S   HC   _H6_    58     1.09538   110.16582  -134.24826
   59    54 S   CT   _C13    59     1.51722   120.17115   175.29347
   60    59 S   HC   _H16    60     1.09741   108.35220   120.06474
   61    59 S   HC   _H17    61     1.09775   110.53146     4.29683
   62    59 S   CT   _C14    62     1.53591   114.20629  -118.46315
   63    62 S   HC   _H18    63     1.09599   110.41083   -59.34142
   64    62 S   HC   _H19    64     1.09569   107.46658  -174.92457
   65    62 S   C3T  _C15    65     1.49889   112.78222    62.63868
   66    65 S   HC   _H3_    66     1.08265   113.53306   -52.48094
   67    65 S   C3T  _C16    67     1.51907   123.26308   155.68979
   68    65 S   O3T  _O35    68     1.43343   114.98492    88.66594
   69    67 S   CT   _C17    69     1.49604   121.66823    -0.47642
   70    69 S   HC   _H20    70     1.09524   110.59840  -161.62139
   71    69 S   HC   _H21    71     1.09459   110.06832    79.05338
   72    69 S   HC   _H22    72     1.09408   112.66345   -41.92167
   73    67 S   CT   _C18    73     1.49696   118.31064   157.32083
   74    73 S   HC   _H23    74     1.09481   110.58538   141.87653
   75    73 S   HC   _H24    75     1.09533   112.08617    21.56220
   76    73 S   HC   _H25    76     1.09429   110.03155   -98.52514
  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  12   5   4   3
  16   2   1   1  12   5   8   3   2   1   9   5   4   2   1   1
   7   4   3  10   3  11   7   3   2   1   9   5   4   8   5   4
  11   4   9   8   7   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    43    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    46    39    40    41    42    43    44    45    49  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    46    47    48    39    40    41    42    43    44    45    49    50    51    52  
   35    36  
   36  
    0  
   38    46    47    48    39    40    41    42    43    44    45    49  
   46    47    48    39    43  
   40    41    42    43    44    45    49    46  
   41    42    43  
   42    43  
   43  
   44    45    49    50    51    52    53    54    46  
   45    49    50    51    52  
   49    50    51    52  
   47    48  
   48  
    0  
   50    51    52    53    54    55    59  
   51    52    53    54  
   52    53    54  
   53    54    55    56    57    58    59    60    61    62  
   54    55    59  
   55    56    57    58    59    60    61    62    63    64    65  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59  
   59  
   60    61    62    63    64    65    66    67    68  
   61    62    63    64    65  
   62    63    64    65  
   63    64    65    66    67    68    69    73  
   64    65    66    67    68  
   65    66    67    68  
   66    67    68    69    70    71    72    73    74    75    76  
   67    68    69    73  
   68    69    70    71    72    73    74    75    76  
   69    70    71    72    73    74    75    76  
   70    71    72    73    74    75    76  
   71    72    73  
   72    73  
   73  
   74    75    76  
   75    76  
   76  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   48   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.120000   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   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   68   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   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  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    39   268.000  1.529
   33    43   268.000  1.529
   37    38   340.000  1.080
   37    46   465.000  1.376
   46    47   745.000  1.250
   46    48   745.000  1.250
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   317.000  1.510
   52    53   340.000  1.080
   52    54   549.000  1.340
   54    55   317.000  1.510
   54    59   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   275.000  1.510
   65    66   340.000  1.088
   65    67   260.000  1.509
   65    68   335.000  1.432
   67    68   335.000  1.432
   67    69   275.000  1.510
   67    73   275.000  1.510
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   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    39    75.00000  111.63000
   29    33    43    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    46    70.00000  124.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   33    43    44    37.50000  110.70000
   33    43    45    37.50000  110.70000
   33    43    49    58.35000  112.70000
   37    46    47    65.00000  137.10300
   37    46    48    65.00000  137.10300
   46    37    38    40.00000  120.50800
   48    46    47    65.00000  121.00000
   39    33    37    70.00000  112.02700
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
   43    33    37    70.00000  112.02700
   43    33    39    58.35000  112.70000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    52    70.00000  112.02700
   45    43    44    33.00000  107.80000
   49    43    44    37.50000  110.70000
   49    43    45    37.50000  110.70000
   49    52    53    35.00000  117.00000
   49    52    54    70.00000  124.00000
   51    49    50    33.00000  107.80000
   52    49    50    35.00000  109.50000
   52    49    51    35.00000  109.50000
   52    54    55    70.00000  124.00000
   52    54    59    70.00000  124.00000
   54    52    53    35.00000  120.00000
   54    55    56    35.00000  109.50000
   54    55    57    35.00000  109.50000
   54    55    58    35.00000  109.50000
   54    59    60    35.00000  109.50000
   54    59    61    35.00000  109.50000
   54    59    62    70.00000  112.02700
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   59    54    55    65.00000  117.92700
   59    62    63    37.50000  110.70000
   59    62    64    37.50000  110.70000
   59    62    65    70.00000  112.37300
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    65    66    40.00000  115.04500
   62    65    67    60.00000  120.94000
   62    65    68    80.00000  116.47100
   64    62    63    33.00000  107.80000
   65    62    63    45.00000  109.38400
   65    62    64    45.00000  109.38400
   65    67    68    15.00000   60.43100
   65    67    69    60.00000  120.94000
   65    67    73    60.00000  120.94000
   65    68    67    15.00000   59.14900
   67    65    66    37.50000  117.20000
   67    69    70    45.00000  109.38400
   67    69    71    45.00000  109.38400
   67    69    72    45.00000  109.38400
   67    73    74    45.00000  109.38400
   67    73    75    45.00000  109.38400
   67    73    76    45.00000  109.38400
   68    65    66    50.00000  114.27700
   68    65    67    15.00000   60.43100
   69    67    68    80.00000  116.47100
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    67    68    80.00000  116.47100
   73    67    69    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    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    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
   24    29    33    43   0.01700  1.0 1.0
   24    29    33    43  -0.23550 -1.0 2.0
   24    29    33    43   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    46   0.42700  1.0 1.0
   29    33    37    46  -0.70350 -1.0 2.0
   29    33    37    46  -0.43150  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   29    33    43    44   0.15000  1.0 3.0
   29    33    43    45   0.15000  1.0 3.0
   29    33    43    49   0.44750  1.0 1.0
   29    33    43    49  -0.17800 -1.0 2.0
   29    33    43    49   0.20200  1.0 3.0
   33    37    46    47   7.00000 -1.0 2.0
   33    37    46    48   7.00000 -1.0 2.0
   33    43    49    50   0.15000  1.0 3.0
   33    43    49    51   0.15000  1.0 3.0
   33    43    49    52   0.34400  1.0 1.0
   33    43    49    52   0.09450 -1.0 2.0
   33    43    49    52   0.11100  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    33    43    44   0.15000  1.0 3.0
   37    33    43    45   0.15000  1.0 3.0
   37    33    43    49   0.34400  1.0 1.0
   37    33    43    49   0.09450 -1.0 2.0
   37    33    43    49   0.11100  1.0 3.0
   38    37    46    47   7.00000 -1.0 2.0
   38    37    46    48   7.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    46   0.09850  1.0 1.0
   39    33    37    46   0.15250 -1.0 2.0
   39    33    37    46  -0.50650  1.0 3.0
   39    33    43    44   0.15000  1.0 3.0
   39    33    43    45   0.15000  1.0 3.0
   39    33    43    49   0.56750  1.0 1.0
   39    33    43    49  -0.07550 -1.0 2.0
   39    33    43    49   0.20000  1.0 3.0
   43    33    37    38   0.00000  1.0 1.0
   43    33    37    46   0.09850  1.0 1.0
   43    33    37    46   0.15250 -1.0 2.0
   43    33    37    46  -0.50650  1.0 3.0
   43    33    39    40   0.15000  1.0 3.0
   43    33    39    41   0.15000  1.0 3.0
   43    33    39    42   0.15000  1.0 3.0
   43    49    52    53   0.00000  1.0 1.0
   43    49    52    54   0.09850  1.0 1.0
   43    49    52    54   0.15250 -1.0 2.0
   43    49    52    54  -0.50650  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    52   0.15000  1.0 3.0
   45    43    49    50   0.15000  1.0 3.0
   45    43    49    51   0.15000  1.0 3.0
   45    43    49    52   0.15000  1.0 3.0
   49    52    54    55   7.00000 -1.0 2.0
   49    52    54    59   7.00000 -1.0 2.0
   50    49    52    53   0.33100  1.0 3.0
   50    49    52    54   0.00000  1.0 1.0
   51    49    52    53   0.33100  1.0 3.0
   51    49    52    54   0.00000  1.0 1.0
   52    54    55    56   0.00000  1.0 1.0
   52    54    55    57   0.00000  1.0 1.0
   52    54    55    58   0.00000  1.0 1.0
   52    54    59    60   0.00000  1.0 1.0
   52    54    59    61   0.00000  1.0 1.0
   52    54    59    62   0.09850  1.0 1.0
   52    54    59    62   0.15250 -1.0 2.0
   52    54    59    62  -0.50650  1.0 3.0
   53    52    54    55   7.00000 -1.0 2.0
   53    52    54    59   7.00000 -1.0 2.0
   54    59    62    63   0.15000  1.0 3.0
   54    59    62    64   0.15000  1.0 3.0
   54    59    62    65   0.34400  1.0 1.0
   54    59    62    65   0.09450 -1.0 2.0
   54    59    62    65   0.11100  1.0 3.0
   55    54    59    60   0.34800  1.0 3.0
   55    54    59    61   0.34800  1.0 3.0
   55    54    59    62   0.46850  1.0 1.0
   55    54    59    62   0.08550 -1.0 2.0
   55    54    59    62   0.09800  1.0 3.0
   59    54    55    56   0.34800  1.0 3.0
   59    54    55    57   0.34800  1.0 3.0
   59    54    55    58   0.34800  1.0 3.0
   59    62    65    66   0.15000  1.0 3.0
   59    62    65    67   0.07850  1.0 1.0
   59    62    65    67  -0.03950 -1.0 2.0
   59    62    65    67   0.67350  1.0 3.0
   59    62    65    68   0.02550  1.0 1.0
   59    62    65    68  -0.02600 -1.0 2.0
   59    62    65    68   1.20400  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    64   0.15000  1.0 3.0
   60    59    62    65   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    64   0.15000  1.0 3.0
   61    59    62    65   0.15000  1.0 3.0
   62    65   -67    68   0.02550  1.0 1.0
   62    65   -67    68  -0.02600 -1.0 2.0
   62    65   -67    68   1.20400  1.0 3.0
   62    65    67    69   0.56750  1.0 1.0
   62    65    67    69  -0.07550 -1.0 2.0
   62    65    67    69   0.20000  1.0 3.0
   62    65    67    73   0.56750  1.0 1.0
   62    65    67    73  -0.07550 -1.0 2.0
   62    65    67    73   0.20000  1.0 3.0
   62    65   -68    67   0.06250  1.0 1.0
   62    65   -68    67  -0.01100 -1.0 2.0
   62    65   -68    67   0.28050  1.0 3.0
   63    62    65    66   0.15000  1.0 3.0
   63    62    65    67   0.15000  1.0 3.0
   63    62    65    68   0.23400  1.0 3.0
   64    62    65    66   0.15000  1.0 3.0
   64    62    65    67   0.15000  1.0 3.0
   64    62    65    68   0.23400  1.0 3.0
   65    67    69    70   0.15000  1.0 3.0
   65    67    69    71   0.15000  1.0 3.0
   65    67    69    72   0.15000  1.0 3.0
   65    67    73    74   0.15000  1.0 3.0
   65    67    73    75   0.15000  1.0 3.0
   65    67    73    76   0.15000  1.0 3.0
   66    65   -67    68   0.23400  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    73   0.15000  1.0 3.0
   66    65   -68    67   0.36800  1.0 3.0
   68    65   -67    69   0.02550  1.0 1.0
   68    65   -67    69  -0.02600 -1.0 2.0
   68    65   -67    69   1.20400  1.0 3.0
   68    65   -67    73   0.02550  1.0 1.0
   68    65   -67    73  -0.02600 -1.0 2.0
   68    65   -67    73   1.20400  1.0 3.0
   68    67    69    70   0.23400  1.0 3.0
   68    67    69    71   0.23400  1.0 3.0
   68    67    69    72   0.23400  1.0 3.0
   68    67    73    74   0.23400  1.0 3.0
   68    67    73    75   0.23400  1.0 3.0
   68    67    73    76   0.23400  1.0 3.0
   69    67   -68    65   0.06250  1.0 1.0
   69    67   -68    65  -0.01100 -1.0 2.0
   69    67   -68    65   0.28050  1.0 3.0
   69    67    73    74   0.15000  1.0 3.0
   69    67    73    75   0.15000  1.0 3.0
   69    67    73    76   0.15000  1.0 3.0
   73    67   -68    65   0.06250  1.0 1.0
   73    67   -68    65  -0.01100 -1.0 2.0
   73    67   -68    65   0.28050  1.0 3.0
   73    67    69    70   0.15000  1.0 3.0
   73    67    69    71   0.15000  1.0 3.0
   73    67    69    72   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    46  15.00000 -1.0 2.0
   47    48    46    37  15.00000 -1.0 2.0
   49    53    52    54  15.00000 -1.0 2.0
   55    59    54    52  15.00000 -1.0 2.0
END
