* LIGAND DATABASE FILE (OPLS2005)
*
001      69    71    133    210     383
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.01991    92.02067    37.05143
    3     1 S   H    _H1_     3     1.02107    32.98353   159.31101
    4     1 S   H    _H2_     4     1.02073    88.45038   -71.61935
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04724   118.98282     8.58904
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08448   106.40438   -11.12153
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08733   110.25787    59.12705
   26    24 S   HC   HB22    34     1.08755   109.66015   178.75008
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C13    36     1.84692    98.14693   161.79653
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT1  _C10    37     1.54570   110.28858    59.98223
   38    37 S   HC   _H28    38     1.09635   111.99838   -31.47424
   39    33 S   CT   _C11    58     1.51670   107.35956   -66.05695
   40    39 S   HC   _H29    59     1.09818   109.95100    93.14597
   41    37 S   N4   _N13    39     1.45016   105.51489    87.56286
   42    37 S   CO3  _C5_    55     1.52159   113.03623  -152.73750
   43    42 S   O2Z  _O14    56     1.26317   114.76310   123.92148
   44    42 S   O2Z  _O16    57     1.26227   115.30024   -56.14776
   45    39 S   CT   _C7_    60     1.51863   113.53136   -30.64846
   46    45 S   HC   _H23    61     1.09363   112.87043    83.78739
   47    45 S   HC   _H24    62     1.09661   111.09322   -37.98819
   48    41 S   C4   _C4_    40     1.36358   126.88750   -86.93654
   49    48 S   O    _O15    41     1.21011   132.76515   -39.31359
   50    41 S   C4T  _C12    44     1.46298   118.38594    36.13662
   51    50 S   HC   _H30    45     1.09387   113.09722   102.63619
   52    45 S   CT   _C6_    63     1.50841   101.49467  -154.47756
   53    52 S   HC   _H21    64     1.09314   113.74075   159.69555
   54    52 S   HC   _H22    65     1.09672   109.80255   -78.82201
   55    48 S   C4T  _C9_    42     1.54123    90.96144   134.71981
   56    55 S   HC   _H27    43     1.09760   111.37643  -115.05439
   57    33 S   S    _S20    46     1.86357   107.91835   176.08593
   58    52 S   CT   _C8_    66     1.51372   101.90573    37.74314
   59    58 S   HC   _H25    67     1.09578   111.18582    87.29165
   60    58 S   HC   _H26    68     1.09402   112.56775  -150.57573
   61    55 S   CT   _C15    47     1.51166   114.87499   119.55250
   62    61 S   HC   _H34    48     1.09796   109.97686   -39.96982
   63    39 S   OS   _O17    69     1.43759   109.85431  -149.37775
   64    61 S   CT   _C14    49     1.52444   112.20102    81.56175
   65    64 S   HC   _H31    50     1.09432   111.11325    57.93399
   66    64 S   HC   _H32    51     1.09517   110.70292   -62.89159
   67    64 S   HC   _H33    52     1.09557   110.94352   178.87953
   68    61 S   OH   _O18    53     1.42715   109.58352  -157.38821
   69    68 S   HO   _H35    54     0.96899   106.42942  -180.00000
  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
  19   2   1   1  15   8  15   7  11   5   1   1  10   6   5  10
   4   8   4   6   5   4  10   5   2   3   2   1   7   6   1   5
   3   2   1   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    57    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    50    57    42    39    40    45    63  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    48    55    50    51    57    42    43    44    39    40    45    46    47    52    58    63  
   35    36  
   36  
    0  
   38    41    48    49    55    50    51    57    42    43    44    39    40    45    63  
   41    48    50    57    42    43    44    39  
   40    45    46    47    52    53    54    58    59    60    63    41    42    50    57  
   45    46    47    52    58    63    57  
   48    49    55    56    50    51    57    61    42    43    44  
   43    44    48    50    57  
   44  
    0  
   46    47    52    53    54    58    59    60    63    57  
   47    52    53    54    58    63  
   52    53    54    58    63  
   49    55    56    50    51    57    61    62    64    68  
   55    56    50    61  
   51    57    61    62    64    68    55    56  
   57    61    55    56  
   53    54    58    59    60    63  
   54    58    59    60    63  
   58    59    60    63  
   56    57    61    62    64    65    66    67    68    69  
   57    61    62    64    68  
   61    63  
   59    60    63  
   60    63  
   63  
   62    64    65    66    67    68    69  
   64    65    66    67    68    69  
    0  
   65    66    67    68    69  
   66    67    68  
   67    68  
   68  
   69  
    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   0.335000   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   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   42   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   50   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   58   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    57   222.000  1.810
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   337.000  1.449
   37    42   317.000  1.522
   41    48   440.000  1.369
   41    50   305.000  1.456
   48    49   930.000  1.212
   48    55   250.000  1.540
   55    56   340.000  1.090
   55    50   268.000  1.529
   55    61   260.000  1.519
   50    51   340.000  1.090
   50    57   200.000  1.824
   61    62   340.000  1.090
   61    64   268.000  1.529
   61    68   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   553.000  0.945
   42    43   656.000  1.250
   42    44   656.000  1.250
   39    40   340.000  1.090
   39    45   268.000  1.529
   39    63   320.000  1.410
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   320.000  1.410
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  108.68000
   29    33    57    75.00000  118.28000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    80.00000  109.70000
   33    37    42    63.00000  111.10000
   33    57    50    85.00000   99.86700
   33    39    40    37.50000  110.70000
   33    39    45    58.35000  112.70000
   33    39    63    50.00000  109.50000
   37    41    48    50.00000  132.10000
   37    41    50    50.00000  132.70000
   37    42    43    70.00000  117.00000
   37    42    44    70.00000  117.00000
   41    37    38    35.00000  109.50000
   41    48    49    75.00000  131.60000
   41    48    55    95.00000   92.72400
   41    50    55   105.00000   87.49700
   41    50    51    50.00000  112.01000
   41    50    57    80.00000  108.62000
   48    55    56    40.00000  113.37500
   48    55    50   100.00000   86.36000
   48    55    61    63.00000  111.10000
   55    48    49    60.00000  136.58000
   55    50    51    37.50000  110.70000
   55    50    57    65.00000  119.05700
   55    61    62    45.00000  111.22300
   55    61    64    70.00000  112.98000
   55    61    68    50.00000  109.50000
   50    41    48   100.00000   93.00000
   50    55    56    37.50000  110.70000
   57    33    37    75.00000  108.68000
   57    50    51    45.00000  109.41400
   61    55    56    45.00000  112.72800
   61    55    50    65.00000  119.52000
   61    64    65    37.50000  110.70000
   61    64    66    37.50000  110.70000
   61    64    67    37.50000  110.70000
   61    68    69    55.00000  108.50000
   64    61    62    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    61    62    35.00000  109.50000
   68    61    64    50.00000  109.50000
   42    37    38    35.00000  109.50000
   42    37    41    63.00000  110.10000
   44    42    43    80.00000  126.00000
   39    33    37    58.35000  112.70000
   39    33    57    75.00000  111.63000
   39    45    46    37.50000  110.70000
   39    45    47    37.50000  110.70000
   39    45    52    58.35000  112.70000
   39    63    58    60.00000  109.50000
   45    39    40    37.50000  110.70000
   45    52    53    37.50000  110.70000
   45    52    54    37.50000  110.70000
   45    52    58    58.35000  112.70000
   47    45    46    33.00000  107.80000
   52    45    46    37.50000  110.70000
   52    45    47    37.50000  110.70000
   52    58    59    37.50000  110.70000
   52    58    60    37.50000  110.70000
   52    58    63    50.00000  109.50000
   54    52    53    33.00000  107.80000
   58    52    53    37.50000  110.70000
   58    52    54    37.50000  110.70000
   60    58    59    33.00000  107.80000
   63    39    40    35.00000  109.50000
   63    39    45    50.00000  109.50000
   63    58    59    35.00000  109.50000
   63    58    60    35.00000  109.50000
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    57   0.08500  1.0 1.0
   24    29    33    57  -0.53150 -1.0 2.0
   24    29    33    57   0.48050  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    41   0.71400  1.0 1.0
   29    33    37    41   0.04300 -1.0 2.0
   29    33    37    41   0.01450  1.0 3.0
   29    33    37    42  -2.17200  1.0 1.0
   29    33    37    42  -0.85700 -1.0 2.0
   29    33    57    50   0.08500  1.0 1.0
   29    33    57    50  -0.53150 -1.0 2.0
   29    33    57    50   0.48050  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    45   0.44750  1.0 1.0
   29    33    39    45  -0.17800 -1.0 2.0
   29    33    39    45   0.20200  1.0 3.0
   29    33    39    63   0.56750  1.0 1.0
   29    33    39    63  -0.07550 -1.0 2.0
   29    33    39    63   0.20000  1.0 3.0
   33    37    41    48   0.00000  1.0 1.0
   33    37   -41    50   0.00000  1.0 1.0
   33    37    42    43   0.00000  1.0 1.0
   33    37    42    44   0.00000  1.0 1.0
   33    39    45    46   0.15000  1.0 3.0
   33    39    45    47   0.15000  1.0 3.0
   33    39    45    52   0.56750  1.0 1.0
   33    39    45    52  -0.07550 -1.0 2.0
   33    39    45    52   0.20000  1.0 3.0
   33    39    63    58   0.06250  1.0 1.0
   33    39    63    58  -0.01100 -1.0 2.0
   33    39    63    58   0.28050  1.0 3.0
   37    33   -57    50  -0.25000 -1.0 2.0
   37    33   -57    50  -0.01800  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    45   0.56750  1.0 1.0
   37    33    39    45  -0.07550 -1.0 2.0
   37    33    39    45   0.20000  1.0 3.0
   37    33    39    63   0.62750  1.0 1.0
   37    33    39    63  -0.30950 -1.0 2.0
   37    33    39    63   0.27300  1.0 3.0
   37    41    48    49   3.00000 -1.0 2.0
   37    41    48    55   3.00000 -1.0 2.0
   37    41   -50    55   0.00000  1.0 1.0
   37    41    50    51   0.00000  1.0 1.0
   37    41   -50    57   0.00000  1.0 1.0
   38    37    41    48   0.00000  1.0 1.0
   38    37    41    50   0.00000  1.0 1.0
   38    37    42    43   0.00000  1.0 1.0
   38    37    42    44   0.00000  1.0 1.0
   41    37    42    43   0.00000  1.0 1.0
   41    37    42    44   0.00000  1.0 1.0
   41    48    55    56   0.00000  1.0 1.0
   41    48   -55    50   3.00000 -1.0 2.0
   41    48    55    61   1.39750  1.0 1.0
   41    48    55    61  -0.07950 -1.0 2.0
   41    48    55    61  -0.18750  1.0 3.0
   41    50   -57    33   0.01700  1.0 1.0
   41    50   -57    33  -0.23550 -1.0 2.0
   41    50   -57    33   0.21350  1.0 3.0
   48    41   -50    55   0.00000  1.0 1.0
   48    41    50    51   0.00000  1.0 1.0
   48    41    50    57   0.00000  1.0 1.0
   48    55   -50    41   3.00000 -1.0 2.0
   48    55   -50    51   0.15000  1.0 3.0
   48    55   -50    57   0.00000  1.0 1.0
   48    55    61    62  -0.11250  1.0 3.0
   48    55    61    64  -0.95700  1.0 1.0
   48    55    61    64  -0.18200 -1.0 2.0
   48    55    61    64   0.29450  1.0 3.0
   48    55    61    68  -0.09450  1.0 1.0
   48    55    61    68  -1.12950 -1.0 2.0
   48    55    61    68   0.54000  1.0 3.0
   49    48    55    56   0.00000  1.0 1.0
   49    48    55    50  -0.11250  1.0 1.0
   49    48    55    50   0.11400 -1.0 2.0
   49    48    55    50  -0.28950  1.0 3.0
   49    48    55    61   0.30150 -1.0 2.0
   55    50    57    33   0.25150  1.0 1.0
   55    50    57    33  -1.17200 -1.0 2.0
   55    50    57    33   0.53050  1.0 3.0
   55    61    64    65   0.15000  1.0 3.0
   55    61    64    66   0.15000  1.0 3.0
   55    61    64    67   0.15000  1.0 3.0
   55    61    68    69  -0.11600  1.0 1.0
   55    61    68    69  -0.09450 -1.0 2.0
   55    61    68    69   0.21250  1.0 3.0
   56    55   -50    41   0.15000  1.0 3.0
   56    55    50    51   0.15000  1.0 3.0
   56    55    50    57   0.00000  1.0 1.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    64   0.15000  1.0 3.0
   56    55    61    68   0.23400  1.0 3.0
   50    41   -48    49   3.00000 -1.0 2.0
   50    41   -48    55   3.00000 -1.0 2.0
   50    55    61    62   0.00000  1.0 1.0
   50    55    61    64   0.04050  1.0 1.0
   50    55    61    64   0.63700 -1.0 2.0
   50    55    61    64   0.17650  1.0 3.0
   50    55    61    68   0.86500  1.0 1.0
   50    55    61    68  -0.17500 -1.0 2.0
   50    55    61    68   0.20800  1.0 3.0
   51    50    57    33   0.00000  1.0 1.0
   57    33    37    38   0.15000  1.0 3.0
   57    33   -37    41   0.71400  1.0 1.0
   57    33   -37    41   0.04300 -1.0 2.0
   57    33   -37    41   0.01450  1.0 3.0
   57    33    37    42  -2.17200  1.0 1.0
   57    33    37    42  -0.85700 -1.0 2.0
   57    33    39    40   0.15000  1.0 3.0
   57    33    39    45   0.44750  1.0 1.0
   57    33    39    45  -0.17800 -1.0 2.0
   57    33    39    45   0.20200  1.0 3.0
   57    33    39    63   0.56750  1.0 1.0
   57    33    39    63  -0.07550 -1.0 2.0
   57    33    39    63   0.20000  1.0 3.0
   61    55   -50    41   0.43900  1.0 1.0
   61    55   -50    41   0.49100 -1.0 2.0
   61    55   -50    41   0.28400  1.0 3.0
   61    55    50    51   0.15000  1.0 3.0
   61    55    50    57   0.44750  1.0 1.0
   61    55    50    57  -0.17800 -1.0 2.0
   61    55    50    57   0.20200  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    67   0.15000  1.0 3.0
   62    61    68    69   0.19450  1.0 3.0
   64    61    68    69  -0.11600  1.0 1.0
   64    61    68    69  -0.09450 -1.0 2.0
   64    61    68    69   0.21250  1.0 3.0
   68    61    64    65   0.23400  1.0 3.0
   68    61    64    66   0.23400  1.0 3.0
   68    61    64    67   0.23400  1.0 3.0
   42    37    41    48   0.00000  1.0 1.0
   42    37    41    50   0.00000  1.0 1.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41   0.42250  1.0 1.0
   39    33    37    41  -0.48100 -1.0 2.0
   39    33    37    41   0.35650  1.0 3.0
   39    33    37    42  -0.84850  1.0 1.0
   39    33    37    42  -0.22800 -1.0 2.0
   39    33    37    42   0.29250  1.0 3.0
   39    33    57    50  -0.25000 -1.0 2.0
   39    33    57    50  -0.01800  1.0 3.0
   39    45    52    53   0.15000  1.0 3.0
   39    45    52    54   0.15000  1.0 3.0
   39    45   -52    58   0.56750  1.0 1.0
   39    45   -52    58  -0.07550 -1.0 2.0
   39    45   -52    58   0.20000  1.0 3.0
   40    39    45    46   0.15000  1.0 3.0
   40    39    45    47   0.15000  1.0 3.0
   40    39    45    52   0.15000  1.0 3.0
   40    39    63    58   0.37050  1.0 3.0
   45    39   -63    58   0.06250  1.0 1.0
   45    39   -63    58  -0.01100 -1.0 2.0
   45    39   -63    58   0.28050  1.0 3.0
   45    52    58    59   0.15000  1.0 3.0
   45    52    58    60   0.15000  1.0 3.0
   45    52   -58    63   0.62750  1.0 1.0
   45    52   -58    63  -0.30950 -1.0 2.0
   45    52   -58    63   0.27300  1.0 3.0
   46    45    52    53   0.15000  1.0 3.0
   46    45    52    54   0.15000  1.0 3.0
   46    45    52    58   0.15000  1.0 3.0
   47    45    52    53   0.15000  1.0 3.0
   47    45    52    54   0.15000  1.0 3.0
   47    45    52    58   0.15000  1.0 3.0
   52    58   -63    39   0.06250  1.0 1.0
   52    58   -63    39  -0.01100 -1.0 2.0
   52    58   -63    39   0.28050  1.0 3.0
   53    52    58    59   0.15000  1.0 3.0
   53    52    58    60   0.15000  1.0 3.0
   53    52    58    63   0.23400  1.0 3.0
   54    52    58    59   0.15000  1.0 3.0
   54    52    58    60   0.15000  1.0 3.0
   54    52    58    63   0.23400  1.0 3.0
   59    58    63    39   0.37050  1.0 3.0
   60    58    63    39   0.37050  1.0 3.0
   63    39    45    46   0.23400  1.0 3.0
   63    39    45    47   0.23400  1.0 3.0
   63    39   -45    52   0.62750  1.0 1.0
   63    39   -45    52  -0.30950 -1.0 2.0
   63    39   -45    52   0.27300  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
   50    48    41    37   1.00000 -1.0 2.0
   41    55    48    49  10.50000 -1.0 2.0
   43    37    42    44  10.50000 -1.0 2.0
END
