* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    130    197     375
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02132   101.49939    16.37412
    3     1 S   H    _H1_     3     1.02151    39.20094   121.90545
    4     1 S   H    _H2_     4     1.02072    75.21185   -90.17317
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08641   109.88695   179.05581
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C10    36     1.82833    97.95982   161.82717
   34    33 S   HC   _H4_    37     1.08975   107.12458   -54.99155
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C11    38     1.49489   109.33439   179.98022
   39    38 S   CM   _C12    39     1.33423   108.59582  -106.82341
   40    38 S   CT   _C13    58     1.50507   123.45231    79.29236
   41    40 S   HC   _H10    59     1.09599   110.19791  -145.59198
   42    40 S   HC   _H11    60     1.09732   109.31816   -29.54381
   43    39 S   OS   _O34    40     1.38798   115.48555    -2.09247
   44    39 S   OH   _O35    69     1.36859   124.03778  -178.45338
   45    44 S   HO   _H9_    70     0.96597   110.44946  -180.00000
   46    33 S   CT   _C9_    41     1.53816   111.72732    68.80068
   47    46 S   HC   _H3_    42     1.09894   109.07646   -13.58485
   48    46 S   C5BC _C8_    43     1.51802   117.92540  -134.03154
   49    48 S   C5BC _C5_    44     1.43538   121.20249   154.62151
   50    49 S   C5A  _C6_    45     1.36917   107.44412   179.52522
   51    50 S   HA   _H8_    46     1.07950   134.07480   179.98022
   52    49 S   CT   _C4_    65     1.47775   127.34167    -0.16193
   53    52 S   HC   _H5_    66     1.10230   111.09757   -90.34842
   54    52 S   HC   _H6_    67     1.10381   111.92700    30.08499
   55    52 S   HC   _H7_    68     1.10241   111.99035   149.09467
   56    50 S   OA   _O33    47     1.34918   110.09301    -0.12511
   57    48 S   C5A  _C7_    48     1.39777   134.17228   -26.46301
   58    57 S   CT   _C17    49     1.50074   137.62208     1.23575
   59    58 S   HC   _H15    50     1.09857   107.09417    78.49582
   60    58 S   HC   _H16    51     1.09830   109.41370  -167.98572
   61    58 S   CM   _C16    52     1.51118   115.99960   -46.08287
   62    61 S   CM   _C15    53     1.34793   118.52986   114.05537
   63    62 S   HC   _H14    54     1.08978   118.72212     8.47162
   64    61 S   CT   _C18    61     1.50397   115.70214   -60.41703
   65    64 S   HC   _H17    62     1.08610   109.26603   -95.97752
   66    64 S   HC   _H18    63     1.08652   109.29400   143.91240
   67    64 S   HC   _H19    64     1.08623   109.31460    24.21345
   68    62 S   CT   _C14    55     1.50149   125.45726  -155.01693
   69    68 S   HC   _H12    56     1.09602   109.69839  -142.58678
   70    68 S   HC   _H13    57     1.09366   112.35403   -24.52416
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  14   7   2   1   1  14  10  11   5   4   7   2   1   8   3  13
   9   8   3   5   2   1   1   5   6  10   4   3   9   8   4   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    46    47    48    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    46    47    48    49    57    68    40    41    42    44  
   38    39    43    46    47    48    40  
   36    37  
   37  
    0  
   39    43    46    47    48    62    68    69    70    40    41    42    44    45  
   43    46    47    48    68    40    41    42    44    45  
   41    42    44    43    46    61    62    63    68    69    70  
   42    62    68    69    70  
   62    68    69    70  
   46    47    48    49    57    44    45  
   45    46  
    0  
   47    48    49    50    56    57    58    52  
   48    49    57  
   49    50    51    56    57    58    59    60    61    52    53    54    55  
   50    51    56    57    58    52    53    54    55  
   51    56    57    58    52    53    54    55  
   56    57    52  
   53    54    55    56    57  
   54    55  
   55  
    0  
   57    58    59    60    61  
   58    59    60    61    62    64  
   59    60    61    62    63    68    64    65    66    67  
   60    61    62    64  
   61    62    64  
   62    63    68    69    70    64    65    66    67  
   63    68    69    70    64    65    66    67  
   68    69    70    64  
   65    66    67    68  
   66    67  
   67  
    0  
   69    70  
   70  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5000   0.0660   0.285000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.143000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   57   3.5500   0.0700   0.008000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    46   268.000  1.529
   38    39   549.000  1.340
   38    40   317.000  1.510
   39    43   440.000  1.360
   39    44   510.000  1.338
   43    46   320.000  1.410
   46    47   340.000  1.090
   46    48   285.000  1.502
   48    49   469.000  1.424
   48    57   546.000  1.367
   49    50   546.000  1.367
   49    52   285.000  1.502
   50    51   367.000  1.080
   50    56   340.000  1.360
   56    57   340.000  1.360
   57    58   295.000  1.489
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   317.000  1.510
   61    62   549.000  1.340
   61    64   317.000  1.510
   62    63   340.000  1.080
   62    68   317.000  1.510
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    40   268.000  1.529
   40    41   340.000  1.090
   40    42   340.000  1.090
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   44    45   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    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    46    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    40    65.00000  117.92700
   33    46    43    50.00000  109.50000
   33    46    47    37.50000  110.70000
   33    46    48    70.00000  112.17500
   38    33    34    35.00000  109.50000
   38    39    43    80.00000  120.01400
   38    39    44    80.00000  121.38400
   38    40    68    70.00000  112.02700
   38    40    41    35.00000  109.50000
   38    40    42    35.00000  109.50000
   39    43    46    90.00000  111.18400
   39    44    45    70.00000  107.45700
   43    46    47    35.00000  109.50000
   43    46    48    85.00000  111.85700
   46    33    34    37.50000  110.70000
   46    33    38    70.00000  112.02700
   46    48    49    60.00000  130.00000
   46    48    57    60.00000  130.00000
   48    46    47    35.00000  109.50000
   48    49    50    70.00000  107.30000
   48    49    52    60.00000  130.00000
   48    57    56    70.00000  110.60000
   48    57    58    50.00000  133.50000
   49    50    51    35.00000  132.10000
   49    50    56    70.00000  110.60000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    55    35.00000  109.50000
   50    56    57    70.00000  106.50000
   56    50    51    35.00000  113.40000
   56    57    58    80.00000  116.10000
   57    48    49    70.00000  107.30000
   57    58    59    45.00000  110.47400
   57    58    60    45.00000  110.47400
   57    58    61    70.00000  112.40000
   58    61    62    70.00000  124.00000
   58    61    64    65.00000  117.92700
   60    58    59    33.00000  107.80000
   61    58    59    35.00000  109.50000
   61    58    60    35.00000  109.50000
   61    62    63    35.00000  120.00000
   61    62    68    70.00000  124.00000
   61    64    65    35.00000  109.50000
   61    64    66    35.00000  109.50000
   61    64    67    35.00000  109.50000
   62    68    69    35.00000  109.50000
   62    68    70    35.00000  109.50000
   62    68    40    70.00000  112.02700
   68    62    63    35.00000  117.00000
   68    40    41    37.50000  110.70000
   68    40    42    37.50000  110.70000
   70    68    69    33.00000  107.80000
   40    38    39    70.00000  124.00000
   40    68    69    37.50000  110.70000
   40    68    70    37.50000  110.70000
   42    40    41    33.00000  107.80000
   64    61    62    70.00000  124.00000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   52    49    50    60.00000  130.00000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   44    39    43   115.00000  116.36000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    46    43   0.56750  1.0 1.0
   29    33    46    43  -0.07550 -1.0 2.0
   29    33    46    43   0.20000  1.0 3.0
   29    33    46    47   0.15000  1.0 3.0
   29    33    46    48   0.56750  1.0 1.0
   29    33    46    48  -0.07550 -1.0 2.0
   29    33    46    48   0.20000  1.0 3.0
   33    38   -39    43   7.00000 -1.0 2.0
   33    38    39    44   7.00000 -1.0 2.0
   33    38    40    68   0.46850  1.0 1.0
   33    38    40    68   0.08550 -1.0 2.0
   33    38    40    68   0.09800  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    42   0.34800  1.0 3.0
   33    46    48    49   0.04150 -1.0 2.0
   33    46    48    57   0.04150 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    46    43   0.23400  1.0 3.0
   34    33    46    47   0.15000  1.0 3.0
   34    33    46    48   0.43200  1.0 3.0
   38    33   -46    43   0.61850  1.0 1.0
   38    33   -46    43  -0.22750 -1.0 2.0
   38    33   -46    43   0.15300  1.0 3.0
   38    33    46    47   0.15000  1.0 3.0
   38    33    46    48   0.21200  1.0 1.0
   38    33    46    48   0.16900 -1.0 2.0
   38    33    46    48  -1.15100  1.0 3.0
   38    39   -43    46  -2.26850  1.0 1.0
   38    39   -43    46   3.39050 -1.0 2.0
   38    39    44    45  -0.66100  1.0 1.0
   38    39    44    45   1.20850 -1.0 2.0
   38    39    44    45  -0.36000  1.0 3.0
   39    38    40    68   0.09850  1.0 1.0
   39    38    40    68   0.15250 -1.0 2.0
   39    38    40    68  -0.50650  1.0 3.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    42   0.00000  1.0 1.0
   39    43   -46    33  -0.46850  1.0 1.0
   39    43   -46    33   0.09300 -1.0 2.0
   39    43   -46    33  -0.12850  1.0 3.0
   39    43    46    47   0.08050  1.0 3.0
   39    43    46    48  -0.48150  1.0 1.0
   39    43    46    48   0.09250 -1.0 2.0
   39    43    46    48  -0.12850  1.0 3.0
   43    39    44    45   2.00000 -1.0 2.0
   43    46    48    49   0.64500  1.0 1.0
   43    46    48    49   0.14800 -1.0 2.0
   43    46    48    49   0.20650  1.0 3.0
   43    46    48    57   0.64500  1.0 1.0
   43    46    48    57   0.14800 -1.0 2.0
   43    46    48    57   0.20650  1.0 3.0
   46    33   -38    39   0.09850  1.0 1.0
   46    33   -38    39   0.15250 -1.0 2.0
   46    33   -38    39  -0.50650  1.0 3.0
   46    33    38    40   0.46850  1.0 1.0
   46    33    38    40   0.08550 -1.0 2.0
   46    33    38    40   0.09800  1.0 3.0
   46    48    49    50   3.62500 -1.0 2.0
   46    48    49    52   3.62500 -1.0 2.0
   46    48    57    56   3.62500 -1.0 2.0
   46    48    57    58   3.62500 -1.0 2.0
   47    46    48    49   0.00000  1.0 1.0
   47    46    48    57   0.00000  1.0 1.0
   48    49    50    51   3.62500 -1.0 2.0
   48    49   -50    56   3.62500 -1.0 2.0
   48    49    52    53   0.00000  1.0 1.0
   48    49    52    54   0.00000  1.0 1.0
   48    49    52    55   0.00000  1.0 1.0
   48    57    58    59   0.00000  1.0 1.0
   48    57    58    60   0.00000  1.0 1.0
   48    57    58    61   0.18050 -1.0 2.0
   49    48   -57    56   3.62500 -1.0 2.0
   49    48    57    58   3.62500 -1.0 2.0
   49    50   -56    57   3.62500 -1.0 2.0
   50    49    52    53   0.00000  1.0 1.0
   50    49    52    54   0.00000  1.0 1.0
   50    49    52    55   0.00000  1.0 1.0
   50    56   -57    48   3.62500 -1.0 2.0
   50    56    57    58   3.62500 -1.0 2.0
   51    50    56    57   3.62500 -1.0 2.0
   56    57    58    59   0.00000  1.0 1.0
   56    57    58    60   0.00000  1.0 1.0
   56    57    58    61   0.04300 -1.0 2.0
   57    48   -49    50   3.62500 -1.0 2.0
   57    48    49    52   3.62500 -1.0 2.0
   57    58    61    62   1.44450  1.0 1.0
   57    58    61    62   0.06600 -1.0 2.0
   57    58    61    62   0.29250  1.0 3.0
   57    58    61    64   0.09700  1.0 1.0
   57    58    61    64   0.15600 -1.0 2.0
   57    58    61    64  -0.50800  1.0 3.0
   58    61    62    63   7.00000 -1.0 2.0
   58    61    62    68   7.00000 -1.0 2.0
   58    61    64    65   0.34800  1.0 3.0
   58    61    64    66   0.34800  1.0 3.0
   58    61    64    67   0.34800  1.0 3.0
   59    58    61    62   0.00000  1.0 1.0
   59    58    61    64   0.34800  1.0 3.0
   60    58    61    62   0.00000  1.0 1.0
   60    58    61    64   0.34800  1.0 3.0
   61    62    68    69   0.00000  1.0 1.0
   61    62    68    70   0.00000  1.0 1.0
   61    62    68    40   0.09850  1.0 1.0
   61    62    68    40   0.15250 -1.0 2.0
   61    62    68    40  -0.50650  1.0 3.0
   62    61    64    65   0.00000  1.0 1.0
   62    61    64    66   0.00000  1.0 1.0
   62    61    64    67   0.00000  1.0 1.0
   62    68    40    38   0.31000  1.0 1.0
   62    68    40    38   0.14700 -1.0 2.0
   62    68    40    38   0.07550  1.0 3.0
   62    68    40    41   0.15000  1.0 3.0
   62    68    40    42   0.15000  1.0 3.0
   63    62    68    69   0.33100  1.0 3.0
   63    62    68    70   0.33100  1.0 3.0
   63    62    68    40   0.00000  1.0 1.0
   69    68    40    38   0.15000  1.0 3.0
   69    68    40    41   0.15000  1.0 3.0
   69    68    40    42   0.15000  1.0 3.0
   70    68    40    38   0.15000  1.0 3.0
   70    68    40    41   0.15000  1.0 3.0
   70    68    40    42   0.15000  1.0 3.0
   40    38    39    43   7.00000 -1.0 2.0
   40    38    39    44   7.00000 -1.0 2.0
   64    61    62    63   7.00000 -1.0 2.0
   64    61    62    68   7.00000 -1.0 2.0
   52    49    50    51   3.62500 -1.0 2.0
   52    49    50    56   3.62500 -1.0 2.0
   44    39    43    46   2.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39   1.10000 -1.0 2.0
   43    44    39    38   1.10000 -1.0 2.0
   49    57    48    46   4.00000 -1.0 2.0
   50    52    49    48   4.00000 -1.0 2.0
   56    51    50    49   1.10000 -1.0 2.0
   56    58    57    48   4.00000 -1.0 2.0
   58    64    61    62   1.10000 -1.0 2.0
   68    63    62    61   1.10000 -1.0 2.0
END
