* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    128    194     369
    1     0 S   NP   _N1_     1    28.00348    95.77704   -23.23478
    2     1 S   H    _HN1     2     1.02835    28.32121   142.59532
    3     1 S   H    _H1_     3     1.02776   103.07231  -113.86277
    4     1 S   H    _H2_     4     1.02958    82.73619    -6.64001
    5     1 S   CT   _CA1     5     1.50130   134.82793   104.97616
    6     5 S   HC   _HA1     6     1.09574   105.21628    77.19053
    7     5 S   CO3  _C1_     7     1.53792   112.38276   -43.00766
    8     7 S   O2Z  _O11     8     1.26367   114.99537   -43.31868
    9     7 S   O2Z  _O12     9     1.26237   114.93789   135.80688
   10     5 S   CT   _CB1    10     1.53101   107.42622  -164.88128
   11    10 S   HC   HB11    11     1.09827   109.34472   -50.38726
   12    10 S   HC   HB12    12     1.09816   110.41841    66.17582
   13    10 S   CT   _CG1    13     1.53014   112.66672  -171.45649
   14    13 S   HC   HG11    14     1.09595   110.48664   -64.29609
   15    13 S   HC   HG12    15     1.09657   109.92009    54.90089
   16    13 S   C    _CD1    16     1.51838   112.33830   175.28840
   17    16 S   O    _OE1    17     1.22748   123.30246     0.23656
   18    16 S   N    _N2_    18     1.38558   111.68220  -179.76097
   19    18 S   H    _HN2    19     1.01554   119.01542     4.55870
   20    18 S   CT1  _CA2    20     1.45823   122.89987   178.28422
   21    20 S   HC   _HA2    21     1.09737   108.92478    24.14067
   22    20 S   C    _C2_    22     1.52924   107.12052   -92.88183
   23    22 S   O    _O2_    23     1.22973   123.06535   -26.46290
   24    20 S   CT   _CB2    32     1.53265   112.17609   147.26476
   25    24 S   HC   HB21    33     1.09508   109.88521    54.05764
   26    24 S   HC   HB22    34     1.09373   109.81254   172.50910
   27    22 S   N    _N3_    24     1.38504   112.52475   156.29220
   28    27 S   H    _HN3    25     1.01662   120.33921    -2.11905
   29    24 S   S    _SG2    35     1.83018   110.71520   -66.73840
   30    27 S   CT   _CA3    26     1.45349   122.51649   178.52462
   31    30 S   HC   HA31    27     1.09564   107.81176   -55.78060
   32    30 S   HC   HA32    28     1.09562   107.61262    60.55927
   33    29 S   CT   _C15    36     1.86357   101.07929  -174.94119
   34    30 S   CO3  _C3_    29     1.52896   114.30796  -177.67468
   35    34 S   O2Z  _O31    30     1.26337   116.06167     0.13706
   36    34 S   O2Z  _O32    31     1.26435   114.41156  -179.89532
   37    33 S   C5BC _C7_    37     1.52306   112.42749    65.21931
   38    33 S   CM   _C8_    45     1.55231   108.45173  -169.90615
   39    37 S   C5BC _C4_    38     1.43325   128.68046    25.83148
   40    39 S   HA   _H19    39     1.08099   127.57722     0.03426
   41    38 S   CT   _C14    46     1.52797   109.14769   114.46744
   42    41 S   HC   _H27    47     1.09593   112.10069   139.33602
   43    38 S   CMA  _C10    58     1.36147   126.07803   -71.12074
   44    43 S   OM   _O16    59     1.26207   132.03983     1.98791
   45    39 S   C5A  _C5_    40     1.37357   107.24583   179.66898
   46    45 S   HA   _H20    41     1.08008   133.79691   179.95154
   47    41 S   CT   _C12    48     1.52604   102.66885    23.03940
   48    47 S   HC   _H23    49     1.09499   112.97469  -159.22461
   49    47 S   HC   _H24    50     1.09597   110.21594    80.86854
   50    41 S   CT   _C18    54     1.53010   113.05412   -96.91464
   51    50 S   HC   _H34    55     1.09474   112.52423    49.85478
   52    50 S   HC   _H35    56     1.09241   111.18941   -70.77546
   53    50 S   HC   _H36    57     1.09548   110.50976   170.45046
   54    43 S   CM   _C9_    60     1.46378   119.21630  -177.03205
   55    54 S   HC   _H22    61     1.09061   113.85028    87.99353
   56    45 S   OA   _O17    42     1.35384   110.35234    -0.40734
   57    33 S   CT   _C13    51     1.55244   107.83952   -59.07646
   58    57 S   HC   _H25    52     1.09595   113.59255    99.61533
   59    57 S   HC   _H26    53     1.09803   112.52699   -21.51630
   60    54 S   CM   _C11    62     1.34982   127.23871   -92.98196
   61    37 S   C5A  _C6_    43     1.38631   127.41934  -155.46920
   62    61 S   HA   _H21    44     1.08012   133.46922     0.48859
   63    60 S   CT   _C16    63     1.50399   120.55929  -179.63792
   64    63 S   HC   _H28    64     1.09491   110.26519   120.02025
   65    63 S   HC   _H29    65     1.09510   112.36164    -0.09891
   66    63 S   HC   _H30    66     1.09494   110.22549  -120.14864
   67    60 S   CT   _C17    67     1.50463   124.77522    -0.38967
   68    67 S   HC   _H31    68     1.09347   113.31049     4.46072
   69    67 S   HC   _H32    69     1.09512   110.15466   124.58916
   70    67 S   HC   _H33    70     1.09499   110.02735  -116.13324
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  20   2   1   1  14  19   7   4  14   9   9   3   4   2   9   5
   4   4   2   1   1  10   3   2   3   1   1   8   1   1   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    38    57    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    61    38    41    47    57    58    59    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    40    45    56    61    62    38    41    42    47    48    49    57    58    59    50    43    44    54  
   35    36  
   36  
    0  
   39    40    45    46    56    61    62    38    41    47    57    58    59    43  
   41    42    47    48    49    57    58    59    50    51    52    53    43    44    54    55    60    39    61  
   40    45    46    56    61    62    57  
   45    46    56    61  
   42    47    48    49    57    58    59    50    51    52    53    43    44    54  
   47    48    49    57    50    51    52    53    43  
   44    54    55    60    63    67    47    50    57  
   54    55    60  
   46    56    61    62  
   56    61  
   48    49    57    58    59    50    51    52    53  
   49    57    58    59    50  
   57    58    59    50  
   51    52    53    57  
   52    53  
   53  
    0  
   55    60    63    64    65    66    67    68    69    70  
   60    63    67  
   61    62  
   58    59    61  
   59  
    0  
   63    64    65    66    67    68    69    70  
   62  
    0  
   64    65    66    67    68    69    70  
   65    66    67  
   66    67  
   67  
   68    69    70  
   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   0.282500   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  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   285.000  1.502
   33    38   317.000  1.510
   33    57   268.000  1.529
   37    39   469.000  1.424
   37    61   546.000  1.367
   39    40   367.000  1.080
   39    45   546.000  1.367
   45    46   367.000  1.080
   45    56   340.000  1.360
   56    61   340.000  1.360
   61    62   367.000  1.080
   38    41   317.000  1.510
   38    43   465.000  1.376
   41    42   340.000  1.090
   41    47   268.000  1.529
   41    50   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   43    44   745.000  1.250
   43    54   465.000  1.376
   54    55   340.000  1.080
   54    60   549.000  1.340
   60    63   317.000  1.510
   60    67   317.000  1.510
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   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    80.00000  109.48900
   29    33    38    75.00000  112.20000
   29    33    57    75.00000  111.63000
   33    37    39    60.00000  130.00000
   33    37    61    60.00000  130.00000
   33    38    41    65.00000  117.92700
   33    38    43    70.00000  124.00000
   33    57    47    58.35000  112.70000
   33    57    58    37.50000  110.70000
   33    57    59    37.50000  110.70000
   37    39    40    35.00000  127.50000
   37    39    45    70.00000  107.30000
   37    61    56    70.00000  110.60000
   37    61    62    35.00000  132.10000
   39    45    46    35.00000  132.10000
   39    45    56    70.00000  110.60000
   45    39    40    35.00000  125.70000
   45    56    61    70.00000  106.50000
   56    45    46    35.00000  113.40000
   56    61    62    35.00000  113.40000
   61    37    39    70.00000  107.30000
   38    33    37    70.00000  112.99600
   38    41    42    35.00000  109.50000
   38    41    47    70.00000  112.02700
   38    41    50    70.00000  112.02700
   38    43    44    65.00000  137.10300
   38    43    54    70.00000  123.01800
   41    47    48    37.50000  110.70000
   41    47    49    37.50000  110.70000
   41    47    57    58.35000  112.70000
   41    50    51    37.50000  110.70000
   41    50    52    37.50000  110.70000
   41    50    53    37.50000  110.70000
   47    41    42    37.50000  110.70000
   47    57    58    37.50000  110.70000
   47    57    59    37.50000  110.70000
   49    47    48    33.00000  107.80000
   57    33    37    70.00000  112.17500
   57    33    38    70.00000  112.02700
   57    47    48    37.50000  110.70000
   57    47    49    37.50000  110.70000
   59    57    58    33.00000  107.80000
   50    41    42    37.50000  110.70000
   50    41    47    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   43    38    41    70.00000  124.00000
   43    54    55    40.00000  120.50800
   43    54    60    70.00000  117.34000
   54    43    44    65.00000  137.10300
   54    60    63    70.00000  124.00000
   54    60    67    70.00000  124.00000
   60    54    55    35.00000  120.00000
   60    63    64    35.00000  109.50000
   60    63    65    35.00000  109.50000
   60    63    66    35.00000  109.50000
   60    67    68    35.00000  109.50000
   60    67    69    35.00000  109.50000
   60    67    70    35.00000  109.50000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    60    63    65.00000  117.92700
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  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    57   0.01700  1.0 1.0
   24    29    33    57  -0.23550 -1.0 2.0
   24    29    33    57   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    39  -0.16000  1.0 1.0
   29    33    37    39  -0.03200 -1.0 2.0
   29    33    37    39   0.04500  1.0 3.0
   29    33    37    61  -0.16000  1.0 1.0
   29    33    37    61  -0.03200 -1.0 2.0
   29    33    37    61   0.04500  1.0 3.0
   29    33    38    41   0.30250  1.0 1.0
   29    33    38    41  -0.14950 -1.0 2.0
   29    33    38    41   0.36900  1.0 3.0
   29    33    38    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    57    47   0.44750  1.0 1.0
   29    33    57    47  -0.17800 -1.0 2.0
   29    33    57    47   0.20200  1.0 3.0
   29    33    57    58   0.15000  1.0 3.0
   29    33    57    59   0.15000  1.0 3.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    45   3.62500 -1.0 2.0
   33    37    61    56   3.62500 -1.0 2.0
   33    37    61    62   3.62500 -1.0 2.0
   33    38    41    42   0.34800  1.0 3.0
   33    38   -41    47   0.46850  1.0 1.0
   33    38   -41    47   0.08550 -1.0 2.0
   33    38   -41    47   0.09800  1.0 3.0
   33    38    41    50   0.46850  1.0 1.0
   33    38    41    50   0.08550 -1.0 2.0
   33    38    41    50   0.09800  1.0 3.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    54   7.00000 -1.0 2.0
   37    33    38    41   0.09700  1.0 1.0
   37    33    38    41   0.15600 -1.0 2.0
   37    33    38    41  -0.50800  1.0 3.0
   37    33    38    43   1.44450  1.0 1.0
   37    33    38    43   0.06600 -1.0 2.0
   37    33    38    43   0.29250  1.0 3.0
   37    33    57    47  -0.03700  1.0 1.0
   37    33    57    47   0.37200 -1.0 2.0
   37    33    57    47  -0.47300  1.0 3.0
   37    33    57    58   0.43200  1.0 3.0
   37    33    57    59   0.43200  1.0 3.0
   37    39    45    46   3.62500 -1.0 2.0
   37    39   -45    56   3.62500 -1.0 2.0
   39    37   -61    56   3.62500 -1.0 2.0
   39    37    61    62   3.62500 -1.0 2.0
   39    45   -56    61   3.62500 -1.0 2.0
   40    39    45    46   3.62500 -1.0 2.0
   40    39    45    56   3.62500 -1.0 2.0
   45    56   -61    37   3.62500 -1.0 2.0
   45    56    61    62   3.62500 -1.0 2.0
   46    45    56    61   3.62500 -1.0 2.0
   61    37    39    40   3.62500 -1.0 2.0
   61    37   -39    45   3.62500 -1.0 2.0
   38    33    37    39   0.18050 -1.0 2.0
   38    33    37    61   0.18050 -1.0 2.0
   38    33   -57    47   0.34400  1.0 1.0
   38    33   -57    47   0.09450 -1.0 2.0
   38    33   -57    47   0.11100  1.0 3.0
   38    33    57    58   0.15000  1.0 3.0
   38    33    57    59   0.15000  1.0 3.0
   38    41    47    48   0.15000  1.0 3.0
   38    41    47    49   0.15000  1.0 3.0
   38    41   -47    57   0.34400  1.0 1.0
   38    41   -47    57   0.09450 -1.0 2.0
   38    41   -47    57   0.11100  1.0 3.0
   38    41    50    51   0.15000  1.0 3.0
   38    41    50    52   0.15000  1.0 3.0
   38    41    50    53   0.15000  1.0 3.0
   38    43    54    55   7.00000 -1.0 2.0
   38    43    54    60   7.00000 -1.0 2.0
   41    38    43    44   7.00000 -1.0 2.0
   41    38    43    54   7.00000 -1.0 2.0
   41    47   -57    33   0.56750  1.0 1.0
   41    47   -57    33  -0.07550 -1.0 2.0
   41    47   -57    33   0.20000  1.0 3.0
   41    47    57    58   0.15000  1.0 3.0
   41    47    57    59   0.15000  1.0 3.0
   42    41    47    48   0.15000  1.0 3.0
   42    41    47    49   0.15000  1.0 3.0
   42    41    47    57   0.15000  1.0 3.0
   42    41    50    51   0.15000  1.0 3.0
   42    41    50    52   0.15000  1.0 3.0
   42    41    50    53   0.15000  1.0 3.0
   47    41    50    51   0.15000  1.0 3.0
   47    41    50    52   0.15000  1.0 3.0
   47    41    50    53   0.15000  1.0 3.0
   48    47    57    33   0.15000  1.0 3.0
   48    47    57    58   0.15000  1.0 3.0
   48    47    57    59   0.15000  1.0 3.0
   49    47    57    33   0.15000  1.0 3.0
   49    47    57    58   0.15000  1.0 3.0
   49    47    57    59   0.15000  1.0 3.0
   57    33    37    39   0.04150 -1.0 2.0
   57    33    37    61   0.04150 -1.0 2.0
   57    33   -38    41   0.46850  1.0 1.0
   57    33   -38    41   0.08550 -1.0 2.0
   57    33   -38    41   0.09800  1.0 3.0
   57    33    38    43   0.09850  1.0 1.0
   57    33    38    43   0.15250 -1.0 2.0
   57    33    38    43  -0.50650  1.0 3.0
   50    41    47    48   0.15000  1.0 3.0
   50    41    47    49   0.15000  1.0 3.0
   50    41    47    57   0.56750  1.0 1.0
   50    41    47    57  -0.07550 -1.0 2.0
   50    41    47    57   0.20000  1.0 3.0
   43    38    41    42   0.00000  1.0 1.0
   43    38    41    47   0.09850  1.0 1.0
   43    38    41    47   0.15250 -1.0 2.0
   43    38    41    47  -0.50650  1.0 3.0
   43    38    41    50   0.09850  1.0 1.0
   43    38    41    50   0.15250 -1.0 2.0
   43    38    41    50  -0.50650  1.0 3.0
   43    54    60    63   7.00000 -1.0 2.0
   43    54    60    67   7.00000 -1.0 2.0
   44    43    54    55   7.00000 -1.0 2.0
   44    43    54    60   7.00000 -1.0 2.0
   54    60    63    64   0.00000  1.0 1.0
   54    60    63    65   0.00000  1.0 1.0
   54    60    63    66   0.00000  1.0 1.0
   54    60    67    68   0.00000  1.0 1.0
   54    60    67    69   0.00000  1.0 1.0
   54    60    67    70   0.00000  1.0 1.0
   55    54    60    63   7.00000 -1.0 2.0
   55    54    60    67   7.00000 -1.0 2.0
   63    60    67    68   0.34800  1.0 3.0
   63    60    67    69   0.34800  1.0 3.0
   63    60    67    70   0.34800  1.0 3.0
   67    60    63    64   0.34800  1.0 3.0
   67    60    63    65   0.34800  1.0 3.0
   67    60    63    66   0.34800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   39    61    37    33   4.00000 -1.0 2.0
   45    40    39    37   1.10000 -1.0 2.0
   56    46    45    39   1.10000 -1.0 2.0
   56    62    61    37   1.10000 -1.0 2.0
   33    41    38    43   1.10000 -1.0 2.0
   54    44    43    38   1.10000 -1.0 2.0
   43    55    54    60  15.00000 -1.0 2.0
   63    67    60    54  15.00000 -1.0 2.0
END
