* LIGAND DATABASE FILE (OPLS2005)
*
001      75    75    137    209     407
    1     0 S   NP   _N1_     1    28.09139    97.27908   -22.39327
    2     1 S   H    _HN1     2     1.02957    73.14855    -3.86498
    3     1 S   H    _H1_     3     1.02835    38.77925   146.12948
    4     1 S   H    _H2_     4     1.02776   101.64821  -109.72610
    5     1 S   CT   _CA1     5     1.50135   141.75524    97.88506
    6     5 S   HC   _HA1     6     1.09575   105.20273    89.13449
    7     5 S   CO3  _C1_     7     1.53782   112.37834   -31.02893
    8     7 S   O2Z  _O11     8     1.26365   114.99289   -43.35327
    9     7 S   O2Z  _O12     9     1.26236   114.93246   135.71135
   10     5 S   CT   _CB1    10     1.53094   107.41851  -152.96570
   11    10 S   HC   HB11    11     1.09827   109.30692   -50.47745
   12    10 S   HC   HB12    12     1.09815   110.43561    66.07527
   13    10 S   CT   _CG1    13     1.53017   112.68264  -171.55059
   14    13 S   HC   HG11    14     1.09596   110.49264   -64.92028
   15    13 S   HC   HG12    15     1.09659   109.91185    54.28017
   16    13 S   C    _CD1    16     1.51844   112.32122   174.63137
   17    16 S   O    _OE1    17     1.22751   123.29977     0.78034
   18    16 S   N    _N2_    18     1.38554   111.70364  -179.17481
   19    18 S   H    _HN2    19     1.01553   119.02683     4.20496
   20    18 S   CT1  _CA2    20     1.45850   122.88608   177.99299
   21    20 S   HC   _HA2    21     1.09733   108.92540    24.54554
   22    20 S   C    _C2_    22     1.52949   106.99656   -92.48985
   23    22 S   O    _O2_    23     1.22979   123.05548   -26.83886
   24    20 S   CT   _CB2    32     1.53403   112.26254   147.74113
   25    24 S   HC   HB21    33     1.09501   109.37135    53.98869
   26    24 S   HC   HB22    34     1.09279   109.62177   172.72856
   27    22 S   N    _N3_    24     1.38496   112.55743   155.95066
   28    27 S   H    _HN3    25     1.01659   120.34047    -2.22809
   29    24 S   S    _SG2    35     1.82697   110.60501   -66.07072
   30    27 S   CT   _CA3    26     1.45356   122.49845   178.57166
   31    30 S   HC   HA31    27     1.09567   107.84625   -55.05499
   32    30 S   HC   HA32    28     1.09561   107.58001    61.28575
   33    29 S   CT   _C11    36     1.89950   103.59092  -171.01030
   34    30 S   CO3  _C3_    29     1.52891   114.31558  -176.96939
   35    34 S   O2Z  _O31    30     1.26337   116.05222     0.42978
   36    34 S   O2Z  _O32    31     1.26433   114.41448  -179.62938
   37    33 S   CT   _C12    37     1.55081   110.78879   -42.67622
   38    37 S   HC   _H10    38     1.09897   109.84376   168.01827
   39    37 S   HC   _H11    39     1.09596   111.93002    54.97160
   40    33 S   CT   _C18    72     1.55580   104.44688    73.18046
   41    40 S   HC   _H21    73     1.09595   112.10204    62.16675
   42    40 S   HC   _H22    74     1.09471   112.30895   -59.19168
   43    40 S   HC   _H23    75     1.09547   111.67171  -177.22667
   44    37 S   CT   _C13    40     1.52594   113.97870   -70.45692
   45    44 S   HC   _H3_    41     1.09393   111.04644    65.85137
   46    44 S   CT   _C14    42     1.52634   111.68127   -57.88850
   47    46 S   HC   _H12    43     1.09908   108.74073   179.80119
   48    46 S   HC   _H13    44     1.09843   108.86117   -67.45290
   49    44 S   OH   _O35    70     1.42858   108.94356  -176.97379
   50    49 S   HO   _H20    71     0.97234   107.44252   -59.82336
   51    46 S   CT   _C15    45     1.55493   113.96435    56.32662
   52    33 S   CT   _C10    46     1.62376   112.60895  -165.20923
   53    52 S   OM   _O36    47     1.32540   109.56324   -47.84835
   54    51 S   CT   _C16    62     1.55706   107.44997    74.33409
   55    54 S   HC   _H14    63     1.09501   112.14062  -179.65908
   56    54 S   HC   _H15    64     1.09761   110.54184    61.72489
   57    54 S   HC   _H16    65     1.08973   113.33103   -56.53840
   58    51 S   CT   _C17    66     1.56124   106.81787  -173.54718
   59    58 S   HC   _H17    67     1.09538   111.59514  -179.83687
   60    58 S   HC   _H18    68     1.09478   112.31540    58.48532
   61    58 S   HC   _H19    69     1.09689   110.93477   -60.33477
   62    52 S   CM   _C9_    48     1.55567   108.50590  -165.99349
   63    62 S   HC   _H9_    49     1.08724   113.16777   -63.64563
   64    62 S   CM   _C8_    50     1.34997   129.94865   116.50685
   65    64 S   HC   _H8_    51     1.08677   118.18768    -0.10653
   66    64 S   CM   _C5_    52     1.46392   126.15895  -179.60833
   67    66 S   CM   _C6_    53     1.34694   123.26902  -178.97473
   68    67 S   HC   _H7_    54     1.09027   119.34251  -177.64216
   69    66 S   CT   _C4_    58     1.50941   118.10135     2.04392
   70    69 S   HC   _H4_    59     1.09558   110.78761    59.37217
   71    69 S   HC   _H5_    60     1.09592   112.26991   178.84309
   72    69 S   HC   _H6_    61     1.09554   110.73617   -61.73427
   73    67 S   CO3  _C7_    55     1.52882   125.16677     1.13918
   74    73 S   O2Z  _O34    56     1.26315   115.63632    67.10467
   75    73 S   O2Z  _O33    57     1.26447   114.45590  -115.22385
  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  13   5   4   3
  19   2   1   1  17   7   6   8   3   2   1  10   6  16   6   5
   2   1  13  14   5   8   3   2   1   4   2   1   1   6   3   9
   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    51    52    53    62    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    51    52    53    62    63    64    54    58    49    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    51    52    53    62    49    50    40    41    42    43  
   39    44    45    46    52    49    40  
   44    45    46    52    49    40  
   41    42    43    44    51    52    53    62  
   42    43    52  
   43    52  
   52  
   45    46    47    48    51    52    54    58    49    50  
   46    47    48    51    49    50  
   47    48    51    52    53    62    54    55    56    57    58    59    60    61    49    50  
   48    51    52    54    58    49  
   51    52    54    58    49  
   50    51  
    0  
   52    53    62    63    64    54    55    56    57    58    59    60    61  
   53    62    63    64    65    66    54    55    56    57    58    59    60    61  
   62    63    64    54    58  
   55    56    57    58    59    60    61    62  
   56    57    58  
   57    58  
   58  
   59    60    61    62  
   60    61  
   61  
    0  
   63    64    65    66    67    69  
   64    65    66  
   65    66    67    68    73    69    70    71    72  
   66    67    69  
   67    68    73    74    75    69    70    71    72  
   68    73    74    75    69    70    71    72  
   73    74    75    69  
   70    71    72    73  
   71    72  
   72  
    0  
   74    75  
   75  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   268.000  1.529
   33    52   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   268.000  1.529
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   268.000  1.529
   51    54   268.000  1.529
   51    58   268.000  1.529
   52    53   570.000  1.307
   52    62   317.000  1.510
   62    63   340.000  1.080
   62    64   549.000  1.340
   64    65   340.000  1.080
   64    66   380.000  1.444
   66    67   549.000  1.340
   66    69   317.000  1.510
   67    68   340.000  1.080
   67    73   230.000  1.545
   73    74   656.000  1.250
   73    75   656.000  1.250
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   49    50   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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  111.63000
   29    33    52    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    58.35000  112.70000
   33    52    51    58.35000  112.70000
   33    52    53    50.00000  109.50000
   33    52    62    70.00000  112.02700
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    37.50000  110.70000
   37    44    46    58.35000  112.70000
   37    44    49    50.00000  109.50000
   39    37    38    33.00000  107.80000
   44    37    38    37.50000  110.70000
   44    37    39    37.50000  110.70000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    51    58.35000  112.70000
   44    49    50    55.00000  108.50000
   46    44    45    37.50000  110.70000
   46    51    52    58.35000  112.70000
   46    51    54    58.35000  112.70000
   46    51    58    58.35000  112.70000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    52    53    50.00000  109.50000
   51    52    62    70.00000  112.02700
   51    54    55    37.50000  110.70000
   51    54    56    37.50000  110.70000
   51    54    57    37.50000  110.70000
   51    58    59    37.50000  110.70000
   51    58    60    37.50000  110.70000
   51    58    61    37.50000  110.70000
   52    33    37    58.35000  112.70000
   52    62    63    35.00000  117.00000
   52    62    64    70.00000  124.00000
   62    52    53    85.00000  110.90400
   62    64    65    35.00000  120.00000
   62    64    66    70.00000  123.01800
   64    62    63    35.00000  120.00000
   64    66    67    70.00000  123.01800
   64    66    69    70.00000  124.00000
   66    64    65    35.00000  120.00000
   66    67    68    35.00000  120.00000
   66    67    73    55.00000  124.75400
   66    69    70    35.00000  109.50000
   66    69    71    35.00000  109.50000
   66    69    72    35.00000  109.50000
   67    73    74    85.00000  113.83300
   67    73    75    85.00000  113.83300
   73    67    68    40.00000  118.53000
   75    73    74    80.00000  126.00000
   69    66    67    70.00000  124.00000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   54    51    52    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   58    51    52    58.35000  112.70000
   58    51    54    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   49    44    45    35.00000  109.50000
   49    44    46    50.00000  109.50000
   40    33    37    58.35000  112.70000
   40    33    52    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.44750  1.0 1.0
   29    33    37    44  -0.17800 -1.0 2.0
   29    33    37    44   0.20200  1.0 3.0
   29    33    52    51   0.44750  1.0 1.0
   29    33    52    51  -0.17800 -1.0 2.0
   29    33    52    51   0.20200  1.0 3.0
   29    33    52    53   0.56750  1.0 1.0
   29    33    52    53  -0.07550 -1.0 2.0
   29    33    52    53   0.20000  1.0 3.0
   29    33    52    62   0.56750  1.0 1.0
   29    33    52    62  -0.07550 -1.0 2.0
   29    33    52    62   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.15000  1.0 3.0
   33    37    44    46   0.56750  1.0 1.0
   33    37    44    46  -0.07550 -1.0 2.0
   33    37    44    46   0.20000  1.0 3.0
   33    37    44    49   0.86500  1.0 1.0
   33    37    44    49  -0.17500 -1.0 2.0
   33    37    44    49   0.20800  1.0 3.0
   33    52    62    63   0.00000  1.0 1.0
   33    52    62    64   0.09850  1.0 1.0
   33    52    62    64   0.15250 -1.0 2.0
   33    52    62    64  -0.50650  1.0 3.0
   37    33    52    51   0.56750  1.0 1.0
   37    33    52    51  -0.07550 -1.0 2.0
   37    33    52    51   0.20000  1.0 3.0
   37    33    52    53   0.62750  1.0 1.0
   37    33    52    53  -0.30950 -1.0 2.0
   37    33    52    53   0.27300  1.0 3.0
   37    33    52    62   0.34400  1.0 1.0
   37    33    52    62   0.09450 -1.0 2.0
   37    33    52    62   0.11100  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    46    47   0.15000  1.0 3.0
   37    44    46    48   0.15000  1.0 3.0
   37    44   -46    51   0.56750  1.0 1.0
   37    44   -46    51  -0.07550 -1.0 2.0
   37    44   -46    51   0.20000  1.0 3.0
   37    44    49    50  -0.11600  1.0 1.0
   37    44    49    50  -0.09450 -1.0 2.0
   37    44    49    50   0.21250  1.0 3.0
   38    37    44    45   0.15000  1.0 3.0
   38    37    44    46   0.15000  1.0 3.0
   38    37    44    49   0.23400  1.0 3.0
   39    37    44    45   0.15000  1.0 3.0
   39    37    44    46   0.15000  1.0 3.0
   39    37    44    49   0.23400  1.0 3.0
   44    46    51    52   0.56750  1.0 1.0
   44    46    51    52  -0.07550 -1.0 2.0
   44    46    51    52   0.20000  1.0 3.0
   44    46    51    54   0.56750  1.0 1.0
   44    46    51    54  -0.07550 -1.0 2.0
   44    46    51    54   0.20000  1.0 3.0
   44    46    51    58   0.56750  1.0 1.0
   44    46    51    58  -0.07550 -1.0 2.0
   44    46    51    58   0.20000  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    51   0.15000  1.0 3.0
   45    44    49    50   0.19450  1.0 3.0
   46    44    49    50  -0.11600  1.0 1.0
   46    44    49    50  -0.09450 -1.0 2.0
   46    44    49    50   0.21250  1.0 3.0
   46    51   -52    33   0.56750  1.0 1.0
   46    51   -52    33  -0.07550 -1.0 2.0
   46    51   -52    33   0.20000  1.0 3.0
   46    51    52    53   0.62750  1.0 1.0
   46    51    52    53  -0.30950 -1.0 2.0
   46    51    52    53   0.27300  1.0 3.0
   46    51    52    62   0.34400  1.0 1.0
   46    51    52    62   0.09450 -1.0 2.0
   46    51    52    62   0.11100  1.0 3.0
   46    51    54    55   0.15000  1.0 3.0
   46    51    54    56   0.15000  1.0 3.0
   46    51    54    57   0.15000  1.0 3.0
   46    51    58    59   0.15000  1.0 3.0
   46    51    58    60   0.15000  1.0 3.0
   46    51    58    61   0.15000  1.0 3.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    54   0.15000  1.0 3.0
   47    46    51    58   0.15000  1.0 3.0
   48    46    51    52   0.15000  1.0 3.0
   48    46    51    54   0.15000  1.0 3.0
   48    46    51    58   0.15000  1.0 3.0
   51    52    62    63   0.00000  1.0 1.0
   51    52    62    64   0.09850  1.0 1.0
   51    52    62    64   0.15250 -1.0 2.0
   51    52    62    64  -0.50650  1.0 3.0
   52    33    37    38   0.15000  1.0 3.0
   52    33    37    39   0.15000  1.0 3.0
   52    33   -37    44   0.56750  1.0 1.0
   52    33   -37    44  -0.07550 -1.0 2.0
   52    33   -37    44   0.20000  1.0 3.0
   52    33    40    41   0.15000  1.0 3.0
   52    33    40    42   0.15000  1.0 3.0
   52    33    40    43   0.15000  1.0 3.0
   52    51    54    55   0.15000  1.0 3.0
   52    51    54    56   0.15000  1.0 3.0
   52    51    54    57   0.15000  1.0 3.0
   52    51    58    59   0.15000  1.0 3.0
   52    51    58    60   0.15000  1.0 3.0
   52    51    58    61   0.15000  1.0 3.0
   52    62    64    65   7.00000 -1.0 2.0
   52    62    64    66   7.00000 -1.0 2.0
   53    52    62    63   0.00000  1.0 1.0
   53    52    62    64   0.39000  1.0 1.0
   53    52    62    64  -0.05800 -1.0 2.0
   53    52    62    64  -0.55150  1.0 3.0
   62    64    66    67   0.28850  1.0 1.0
   62    64    66    67   2.61350 -1.0 2.0
   62    64    66    67   0.78400  1.0 3.0
   62    64    66    69  -0.18600  1.0 3.0
   63    62    64    65   7.00000 -1.0 2.0
   63    62    64    66   7.00000 -1.0 2.0
   64    66    67    68   7.00000 -1.0 2.0
   64    66    67    73   7.00000 -1.0 2.0
   64    66    69    70   0.00000  1.0 1.0
   64    66    69    71   0.00000  1.0 1.0
   64    66    69    72   0.00000  1.0 1.0
   65    64    66    67  -0.18600  1.0 3.0
   65    64    66    69   0.00000  1.0 1.0
   66    67    73    74  -0.04000 -1.0 2.0
   66    67    73    74  -0.29050  1.0 3.0
   66    67    73    75  -0.04000 -1.0 2.0
   66    67    73    75  -0.29050  1.0 3.0
   67    66    69    70   0.00000  1.0 1.0
   67    66    69    71   0.00000  1.0 1.0
   67    66    69    72   0.00000  1.0 1.0
   68    67    73    74   0.00000  1.0 1.0
   68    67    73    75   0.00000  1.0 1.0
   69    66    67    68   7.00000 -1.0 2.0
   69    66    67    73   7.00000 -1.0 2.0
   54    51    52    33   0.56750  1.0 1.0
   54    51    52    33  -0.07550 -1.0 2.0
   54    51    52    33   0.20000  1.0 3.0
   54    51    52    53   0.62750  1.0 1.0
   54    51    52    53  -0.30950 -1.0 2.0
   54    51    52    53   0.27300  1.0 3.0
   54    51    52    62   0.34400  1.0 1.0
   54    51    52    62   0.09450 -1.0 2.0
   54    51    52    62   0.11100  1.0 3.0
   54    51    58    59   0.15000  1.0 3.0
   54    51    58    60   0.15000  1.0 3.0
   54    51    58    61   0.15000  1.0 3.0
   58    51    52    33   0.56750  1.0 1.0
   58    51    52    33  -0.07550 -1.0 2.0
   58    51    52    33   0.20000  1.0 3.0
   58    51    52    53   0.62750  1.0 1.0
   58    51    52    53  -0.30950 -1.0 2.0
   58    51    52    53   0.27300  1.0 3.0
   58    51    52    62   0.34400  1.0 1.0
   58    51    52    62   0.09450 -1.0 2.0
   58    51    52    62   0.11100  1.0 3.0
   58    51    54    55   0.15000  1.0 3.0
   58    51    54    56   0.15000  1.0 3.0
   58    51    54    57   0.15000  1.0 3.0
   49    44    46    47   0.23400  1.0 3.0
   49    44    46    48   0.23400  1.0 3.0
   49    44    46    51   0.86500  1.0 1.0
   49    44    46    51  -0.17500 -1.0 2.0
   49    44    46    51   0.20800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.56750  1.0 1.0
   40    33    37    44  -0.07550 -1.0 2.0
   40    33    37    44   0.20000  1.0 3.0
   40    33    52    51   0.56750  1.0 1.0
   40    33    52    51  -0.07550 -1.0 2.0
   40    33    52    51   0.20000  1.0 3.0
   40    33    52    53   0.62750  1.0 1.0
   40    33    52    53  -0.30950 -1.0 2.0
   40    33    52    53   0.27300  1.0 3.0
   40    33    52    62   0.34400  1.0 1.0
   40    33    52    62   0.09450 -1.0 2.0
   40    33    52    62   0.11100  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
   52    63    62    64  15.00000 -1.0 2.0
   66    65    64    62  15.00000 -1.0 2.0
   64    69    66    67  15.00000 -1.0 2.0
   73    68    67    66  15.00000 -1.0 2.0
   74    67    73    75  10.50000 -1.0 2.0
END
