* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    126    199     369
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02068    64.90772    74.88315
    3     1 S   H    _H1_     3     1.02120    47.65255  -130.23126
    4     1 S   H    _H2_     4     1.02031   105.54414   -28.83960
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08547   109.95733   179.14202
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C16    36     1.85215    97.19627  -178.15729
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   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   CA   _C15    37     1.51306   107.98921   -79.99208
   38    33 S   CM   _C7_    50     1.51198   109.62502   158.10596
   39    37 S   CA   _C14    38     1.40155   122.03136    86.25268
   40    39 S   HA   _H10    39     1.08700   120.65822     3.38830
   41    38 S   CT   _C6_    51     1.51532   108.36544  -101.47577
   42    39 S   CA   _C13    40     1.39567   120.35654  -175.59958
   43    42 S   HA   _H9_    41     1.08588   119.85542   179.94766
   44    41 S   CT   _C5_    52     1.54588    97.82854   -30.37000
   45    44 S   HC   _H3_    53     1.09977   110.01081   -80.25181
   46    41 S   CT   _C17    59     1.53659   111.34682    89.48059
   47    46 S   HC   _H12    60     1.08515   109.39345   179.96574
   48    46 S   HC   _H13    61     1.08635   109.32749    59.97748
   49    46 S   HC   _H14    62     1.08552   109.37314   -59.98249
   50    41 S   CT   _C18    63     1.53898   115.67515  -146.33528
   51    50 S   HC   _H15    64     1.08544   109.27581  -179.98022
   52    50 S   HC   _H16    65     1.08491   109.27514    60.03582
   53    50 S   HC   _H17    66     1.08537   109.24121   -60.04084
   54    42 S   CA   _C12    42     1.39504   120.23631     0.56614
   55    54 S   HA   _H8_    43     1.08640   119.83998   179.71469
   56    33 S   OS   _O34    54     1.43711   109.56554    42.90910
   57    44 S   CT   _C4_    55     1.52129   116.35088   156.62031
   58    57 S   HC   _H4_    56     1.09133   110.08177   -55.80055
   59    57 S   HC   _H5_    57     1.08998   110.11712  -175.79826
   60    57 S   HC   _H6_    58     1.09049   110.10308    64.14206
   61    54 S   CA   _C11    44     1.39315   120.18274    -0.31404
   62    61 S   HA   _H7_    45     1.08649   119.11849  -179.35290
   63    37 S   CA   _C10    46     1.40614   119.00829   -89.09946
   64    63 S   CO4  _C9_    47     1.48406   119.38054    -6.43611
   65    64 S   O    _O33    48     1.22472   121.48271   163.08652
   66    64 S   CM   _C8_    49     1.49089   116.88989   -21.36266
   67    66 S   OH   _O35    67     1.37484   117.85858  -154.48596
   68    67 S   HO   _H11    68     0.96443   110.13187    -0.03956
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  17   2   1   1  15  20   9   4  18   6   3  15   7  10   3   2
   1   6   2   1   1   5   3   6   3   2   1   1   5   2   4   4
   2   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    56    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    63    66    38    41    44    56  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    40    42    61    63    64    66    38    41    44    45    56    57    46    50    67  
   35    36  
   36  
    0  
   39    40    42    43    54    61    62    63    64    65    66    38    41    44    56  
   41    44    45    56    57    46    47    48    49    50    51    52    53    67    68    39    63    64    65    66  
   40    42    43    54    55    61    63    64    56  
   42    43    54    63  
   44    45    56    57    58    59    60    46    47    48    49    50    51    52    53    67    64    66  
   43    54    55    61    62    63  
   54    55    61  
   45    56    57    58    59    60    46    47    48    49    50    51    52    53    66  
   56    57    58    59    60    46    50  
   47    48    49    50    51    52    53    56    57    66  
   48    49    50  
   49    50  
   50  
   51    52    53    56    57    66  
   52    53  
   53  
    0  
   55    61    62    63    64  
   61    62    63  
   57    58    59    60    63    66  
   58    59    60  
   59    60  
   60  
    0  
   62    63    64    65    66  
   63    64  
   64    65    66    67  
   65    66    67    68  
   66    67  
   67    68  
   68  
    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  -0.316400   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   0.459700   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   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.180000   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   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   67   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.355200   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   317.000  1.510
   33    38   317.000  1.510
   33    56   320.000  1.410
   37    39   469.000  1.400
   37    63   469.000  1.400
   39    40   367.000  1.080
   39    42   469.000  1.400
   42    43   367.000  1.080
   42    54   469.000  1.400
   54    55   367.000  1.080
   54    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   310.000  1.470
   64    65   570.000  1.229
   64    66   320.000  1.462
   66    38   549.000  1.340
   66    67   510.000  1.338
   38    41   317.000  1.510
   41    44   268.000  1.529
   41    46   268.000  1.529
   41    50   268.000  1.529
   44    45   340.000  1.090
   44    56   320.000  1.410
   44    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   67    68   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    56    85.00000  114.68000
   33    37    39    70.00000  120.00000
   33    37    63    70.00000  120.00000
   33    38    66    70.00000  124.00000
   33    38    41    65.00000  117.92700
   33    56    44    60.00000  109.50000
   37    39    40    35.00000  120.00000
   37    39    42    63.00000  120.00000
   37    63    61    63.00000  120.00000
   37    63    64    60.00000  119.52600
   39    42    43    35.00000  120.00000
   39    42    54    63.00000  120.00000
   42    39    40    35.00000  120.00000
   42    54    55    35.00000  120.00000
   42    54    61    63.00000  120.00000
   54    42    43    35.00000  120.00000
   54    61    62    35.00000  120.00000
   54    61    63    63.00000  120.00000
   61    54    55    35.00000  120.00000
   61    63    64    60.00000  119.52600
   63    37    39    63.00000  120.00000
   63    61    62    35.00000  120.00000
   63    64    65    75.00000  123.78400
   63    64    66    65.00000  117.02400
   64    66    38    65.00000  118.96000
   64    66    67    85.00000  116.28000
   66    64    65    80.00000  123.72100
   66    38    41    70.00000  124.00000
   66    67    68    70.00000  107.45700
   38    33    37    70.00000  112.99600
   38    41    44    70.00000  112.02700
   38    41    46    70.00000  112.02700
   38    41    50    70.00000  112.02700
   41    44    45    37.50000  110.70000
   41    44    56    50.00000  109.50000
   41    44    57    58.35000  112.70000
   41    46    47    37.50000  110.70000
   41    46    48    37.50000  110.70000
   41    46    49    37.50000  110.70000
   41    50    51    37.50000  110.70000
   41    50    52    37.50000  110.70000
   41    50    53    37.50000  110.70000
   44    57    58    37.50000  110.70000
   44    57    59    37.50000  110.70000
   44    57    60    37.50000  110.70000
   56    33    37    85.00000  111.85700
   56    33    38    85.00000  110.90400
   56    44    45    35.00000  109.50000
   57    44    45    37.50000  110.70000
   57    44    56    50.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   46    41    44    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
   50    41    44    58.35000  112.70000
   50    41    46    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
   67    66    38    80.00000  121.38400
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    56   0.13850  1.0 1.0
   24    29    33    56  -1.34450 -1.0 2.0
   24    29    33    56   0.57400  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    63  -0.16000  1.0 1.0
   29    33    37    63  -0.03200 -1.0 2.0
   29    33    37    63   0.04500  1.0 3.0
   29    33    38    66   0.42700  1.0 1.0
   29    33    38    66  -0.70350 -1.0 2.0
   29    33    38    66  -0.43150  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    56    44   0.14700  1.0 1.0
   29    33    56    44  -1.16150 -1.0 2.0
   29    33    56    44   0.48700  1.0 3.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    42   3.62500 -1.0 2.0
   33    37    63    61   3.62500 -1.0 2.0
   33    37    63    64   3.62500 -1.0 2.0
   33    38   -41    44   0.46850  1.0 1.0
   33    38   -41    44   0.08550 -1.0 2.0
   33    38   -41    44   0.09800  1.0 3.0
   33    38    41    46   0.46850  1.0 1.0
   33    38    41    46   0.08550 -1.0 2.0
   33    38    41    46   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
   37    33    38    66   1.44450  1.0 1.0
   37    33    38    66   0.06600 -1.0 2.0
   37    33    38    66   0.29250  1.0 3.0
   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    56    44   0.37500  1.0 3.0
   37    39    42    43   3.62500 -1.0 2.0
   37    39    42    54   3.62500 -1.0 2.0
   37    63    64    65   1.05000 -1.0 2.0
   37    63   -64    66  -0.11500  1.0 1.0
   37    63   -64    66   1.10450 -1.0 2.0
   37    63   -64    66  -0.48050  1.0 3.0
   39    37    63    61   3.62500 -1.0 2.0
   39    37    63    64   3.62500 -1.0 2.0
   39    42    54    55   3.62500 -1.0 2.0
   39    42   -54    61   3.62500 -1.0 2.0
   40    39    42    43   3.62500 -1.0 2.0
   40    39    42    54   3.62500 -1.0 2.0
   42    54    61    62   3.62500 -1.0 2.0
   42    54    61    63   3.62500 -1.0 2.0
   43    42    54    55   3.62500 -1.0 2.0
   43    42    54    61   3.62500 -1.0 2.0
   54    61   -63    37   3.62500 -1.0 2.0
   54    61    63    64   3.62500 -1.0 2.0
   55    54    61    62   3.62500 -1.0 2.0
   55    54    61    63   3.62500 -1.0 2.0
   61    63    64    65   1.05000 -1.0 2.0
   61    63    64    66  -0.11500  1.0 1.0
   61    63    64    66   1.10450 -1.0 2.0
   61    63    64    66  -0.48050  1.0 3.0
   62    61    63    37   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   63    37    39    40   3.62500 -1.0 2.0
   63    37   -39    42   3.62500 -1.0 2.0
   63    64    66    38  -1.65800  1.0 1.0
   63    64    66    38   0.77650 -1.0 2.0
   63    64    66    67   1.50000 -1.0 2.0
   64    66   -38    33   7.00000 -1.0 2.0
   64    66    38    41   7.00000 -1.0 2.0
   64    66    67    68   2.00000 -1.0 2.0
   65    64    66    38   1.00000 -1.0 2.0
   65    64    66    67  -0.11900  1.0 1.0
   65    64    66    67   0.76850 -1.0 2.0
   65    64    66    67   0.14100  1.0 3.0
   66    38    41    44   0.09850  1.0 1.0
   66    38    41    44   0.15250 -1.0 2.0
   66    38    41    44  -0.50650  1.0 3.0
   66    38    41    46   0.09850  1.0 1.0
   66    38    41    46   0.15250 -1.0 2.0
   66    38    41    46  -0.50650  1.0 3.0
   66    38    41    50   0.09850  1.0 1.0
   66    38    41    50   0.15250 -1.0 2.0
   66    38    41    50  -0.50650  1.0 3.0
   38    33    37    39   0.18050 -1.0 2.0
   38    33   -37    63   0.18050 -1.0 2.0
   38    33   -56    44  -0.77900  1.0 1.0
   38    33   -56    44  -0.36900 -1.0 2.0
   38    33   -56    44   0.40400  1.0 3.0
   38    66    67    68  -0.66100  1.0 1.0
   38    66    67    68   1.20850 -1.0 2.0
   38    66    67    68  -0.36000  1.0 3.0
   38    41    44    45   0.15000  1.0 3.0
   38    41   -44    56   0.61850  1.0 1.0
   38    41   -44    56  -0.22750 -1.0 2.0
   38    41   -44    56   0.15300  1.0 3.0
   38    41    44    57   0.34400  1.0 1.0
   38    41    44    57   0.09450 -1.0 2.0
   38    41    44    57   0.11100  1.0 3.0
   38    41    46    47   0.15000  1.0 3.0
   38    41    46    48   0.15000  1.0 3.0
   38    41    46    49   0.15000  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
   41    44   -56    33   0.06250  1.0 1.0
   41    44   -56    33  -0.01100 -1.0 2.0
   41    44   -56    33   0.28050  1.0 3.0
   41    44    57    58   0.15000  1.0 3.0
   41    44    57    59   0.15000  1.0 3.0
   41    44    57    60   0.15000  1.0 3.0
   44    41    46    47   0.15000  1.0 3.0
   44    41    46    48   0.15000  1.0 3.0
   44    41    46    49   0.15000  1.0 3.0
   44    41    50    51   0.15000  1.0 3.0
   44    41    50    52   0.15000  1.0 3.0
   44    41    50    53   0.15000  1.0 3.0
   45    44    56    33   0.37050  1.0 3.0
   45    44    57    58   0.15000  1.0 3.0
   45    44    57    59   0.15000  1.0 3.0
   45    44    57    60   0.15000  1.0 3.0
   56    33    37    39   0.64500  1.0 1.0
   56    33    37    39   0.14800 -1.0 2.0
   56    33    37    39   0.20650  1.0 3.0
   56    33    37    63   0.64500  1.0 1.0
   56    33    37    63   0.14800 -1.0 2.0
   56    33    37    63   0.20650  1.0 3.0
   56    33    38    66   0.39000  1.0 1.0
   56    33    38    66  -0.05800 -1.0 2.0
   56    33    38    66  -0.55150  1.0 3.0
   56    33   -38    41   0.09700  1.0 1.0
   56    33   -38    41   0.15600 -1.0 2.0
   56    33   -38    41  -0.50800  1.0 3.0
   56    44    57    58   0.23400  1.0 3.0
   56    44    57    59   0.23400  1.0 3.0
   56    44    57    60   0.23400  1.0 3.0
   57    44    56    33   0.06250  1.0 1.0
   57    44    56    33  -0.01100 -1.0 2.0
   57    44    56    33   0.28050  1.0 3.0
   46    41    44    45   0.15000  1.0 3.0
   46    41    44    56   0.62750  1.0 1.0
   46    41    44    56  -0.30950 -1.0 2.0
   46    41    44    56   0.27300  1.0 3.0
   46    41    44    57   0.56750  1.0 1.0
   46    41    44    57  -0.07550 -1.0 2.0
   46    41    44    57   0.20000  1.0 3.0
   46    41    50    51   0.15000  1.0 3.0
   46    41    50    52   0.15000  1.0 3.0
   46    41    50    53   0.15000  1.0 3.0
   50    41    44    45   0.15000  1.0 3.0
   50    41    44    56   0.62750  1.0 1.0
   50    41    44    56  -0.30950 -1.0 2.0
   50    41    44    56   0.27300  1.0 3.0
   50    41    44    57   0.56750  1.0 1.0
   50    41    44    57  -0.07550 -1.0 2.0
   50    41    44    57   0.20000  1.0 3.0
   50    41    46    47   0.15000  1.0 3.0
   50    41    46    48   0.15000  1.0 3.0
   50    41    46    49   0.15000  1.0 3.0
   67    66    38    33   7.00000 -1.0 2.0
   67    66    38    41   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   39    63    37    33   4.00000 -1.0 2.0
   42    40    39    37   1.10000 -1.0 2.0
   54    43    42    39   1.10000 -1.0 2.0
   61    55    54    42   1.10000 -1.0 2.0
   63    62    61    54   1.10000 -1.0 2.0
   61    64    63    37   4.00000 -1.0 2.0
   63    66    64    65  10.50000 -1.0 2.0
   64    67    66    38   1.10000 -1.0 2.0
   33    41    38    66   1.10000 -1.0 2.0
END
