* LIGAND DATABASE FILE (OPLS2005)
*
001      76    78    139    228     414
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02009    55.99334    87.36690
    3     1 S   H    _H1_     3     1.02103    56.10162  -115.97371
    4     1 S   H    _H2_     4     1.02080   106.65812   -14.33614
    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     1.08491   110.56590    58.74922
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   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   _C13    36     1.84591    97.41096  -158.15226
   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   CM   _C14    37     1.51051   109.26557   179.98022
   38    37 S   CM   _C15    38     1.33967   123.52936    88.90008
   39    38 S   HC   _H13    39     1.08236   123.34270   179.66254
   40    37 S   NE   _N5_    47     1.40689   109.69313   -95.61156
   41    38 S   CO4  _C16    40     1.47936   119.20963     1.18366
   42    41 S   O    _O33    41     1.22131   122.53268  -169.85770
   43    40 S   CT1  _C11    48     1.47176   111.31624    -6.04244
   44    43 S   HC   _H4_    49     1.09498   109.47359  -130.70882
   45    40 S   CM   _C10    56     1.54682   127.64834  -179.35350
   46    45 S   HC   _H10    57     1.09837   122.69888   -30.01756
   47    41 S   CO4  _C17    42     1.51125   118.66353    11.39712
   48    47 S   O    _O34    43     1.22179   118.46954  -174.39503
   49    33 S   CT   _C12    50     1.54014   110.46109    69.07730
   50    49 S   HC   _H11    51     1.09601   113.33769   -36.50831
   51    49 S   HC   _H12    52     1.09930   109.77963  -155.31907
   52    43 S   CO3  _C19    53     1.51259   109.58277   108.83320
   53    52 S   O2Z  _O36    54     1.26229   115.27700    30.24551
   54    52 S   O2Z  _O35    55     1.26231   114.83246  -149.72249
   55    45 S   CM   _C9_    58     1.46283   116.53599   149.95905
   56    55 S   HC   _H9_    59     1.08287   120.12537   -29.99691
   57    33 S   CT   _C18    44     1.52730   109.78219   -57.21418
   58    57 S   HC   _H14    45     1.09762   111.10635   169.97948
   59    57 S   HC   _H15    46     1.09661   111.64968    50.26876
   60    55 S   CM   _C8_    60     1.34054   118.26853   150.00949
   61    60 S   CM   _C7_    61     1.45601   121.69972     0.00000
   62    61 S   HC   _H8_    62     1.08581   118.28613   -11.07645
   63    61 S   CM   _C6_    63     1.34139   120.12171   168.17422
   64    63 S   NE   _N4_    64     1.37445   123.38212    -2.25420
   65    64 S   H    _H7_    65     1.01447   117.38787  -176.80972
   66    63 S   CMA  _C20    74     1.51390   116.66691   179.14981
   67    66 S   OM   _O38    75     1.26244   115.14142   -59.98867
   68    66 S   OM   _O37    76     1.26345   115.07733   120.02943
   69    64 S   CT1  _C5_    66     1.44729   122.88569    -6.02851
   70    69 S   HC   _H3_    67     1.09504   110.07679   149.81865
   71    60 S   CT   _C4_    68     1.52008   121.96194  -179.11729
   72    71 S   HC   _H5_    69     1.09746   110.61014   -22.52055
   73    71 S   HC   _H6_    70     1.09963   107.11943    93.34031
   74    69 S   CO3  _C21    71     1.51412   105.97509   -93.40560
   75    74 S   O2Z  _O40    72     1.26229   115.27188    61.96397
   76    74 S   O2Z  _O39    73     1.26321   114.81337  -118.04897
  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  12   5   4   3
  17   2   1   1  18  10   4  15   6   3  11   7   8   3   5   3
   8   3   2   2   1   1   9   3   2   1   1  11  11   4   9  12
   5   3   1   1   7   6   5   2   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    57    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    47    57    58    59    40    43    49    50    51  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    47    48    57    58    59    40    43    44    49    50    51    52    45  
   35    36  
   36  
    0  
   38    39    41    42    47    57    58    59    40    43    44    49    50    51    52    45    46    55  
   39    41    42    47    48    57    40    43    49    45  
   41    42    47    40  
   43    44    49    50    51    52    53    54    45    46    55    56    60    41    57  
   42    47    48    57    58    59  
   47    48    57  
   44    49    50    51    52    53    54    45    46    55    57  
   49    50    51    52    53    54    45  
   46    55    56    60    61    71    49    52  
   55    56    60  
   48    57    58    59    49  
   57    58    59  
   50    51    52    53    54    57    58    59  
   51    52    57  
   52    57  
   53    54  
   54  
    0  
   56    60    61    62    63    69    71    72    73  
   60    61    71  
   58    59  
   59  
    0  
   61    62    63    64    69    70    71    72    73    74    66  
   62    63    64    65    69    71    72    73    66    67    68  
   63    64    71    66  
   64    65    69    70    71    74    66    67    68  
   65    69    70    71    72    73    74    75    76    66    67    68  
   69    70    71    74    66  
   67    68    69  
   68  
    0  
   70    71    72    73    74    75    76  
   71    72    73    74    75    76  
   72    73    74    75    76  
   73    74  
   74  
   75    76  
   76  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.2500   0.1700  -0.158500   1.9050   1.6860   0.051222218  -2.220205820
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5500   0.0760  -0.097000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.583200   2.0020   1.7750   0.023028004  -0.852763146
   64   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   65   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   68   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   69   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    57   268.000  1.529
   33    49   268.000  1.529
   37    38   549.000  1.340
   37    40   425.000  1.378
   38    39   340.000  1.080
   38    41   320.000  1.462
   41    42   570.000  1.229
   41    47   250.000  1.523
   47    48   570.000  1.229
   47    57   317.000  1.522
   57    58   340.000  1.090
   57    59   340.000  1.090
   40    43   382.000  1.448
   40    45   425.000  1.378
   43    44   340.000  1.090
   43    49   268.000  1.529
   43    52   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   52    53   656.000  1.250
   52    54   656.000  1.250
   45    46   340.000  1.080
   45    55   549.000  1.340
   55    56   340.000  1.080
   55    60   380.000  1.444
   60    61   549.000  1.340
   60    71   317.000  1.510
   61    62   340.000  1.080
   61    63   380.000  1.444
   63    64   425.000  1.378
   63    66   465.000  1.376
   64    65   434.000  1.010
   64    69   382.000  1.448
   69    70   340.000  1.090
   69    71   268.000  1.529
   69    74   317.000  1.522
   71    72   340.000  1.090
   71    73   340.000  1.090
   74    75   656.000  1.250
   74    76   656.000  1.250
   66    67   745.000  1.250
   66    68   745.000  1.250
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  112.20000
   29    33    57    75.00000  111.63000
   29    33    49    75.00000  111.63000
   33    37    38    70.00000  124.00000
   33    37    40    75.00000  116.24600
   33    57    47    63.00000  111.10000
   33    57    58    37.50000  110.70000
   33    57    59    37.50000  110.70000
   33    49    43    58.35000  112.70000
   33    49    50    37.50000  110.70000
   33    49    51    37.50000  110.70000
   37    38    39    35.00000  120.00000
   37    38    41    65.00000  118.96000
   37    40    43    50.00000  121.00000
   37    40    45    75.00000  118.45600
   38    41    42    80.00000  123.72100
   38    41    47    65.00000  116.00000
   41    38    39    40.00000  117.72500
   41    47    48    80.00000  119.30300
   41    47    57    65.00000  115.45000
   47    41    42    80.00000  119.30300
   47    57    58    35.00000  109.50000
   47    57    59    35.00000  109.50000
   57    33    37    70.00000  112.02700
   57    47    48    80.00000  120.40000
   59    57    58    33.00000  107.80000
   40    37    38    70.00000  124.03900
   40    43    44    35.00000  109.50000
   40    43    49    80.00000  111.61500
   40    43    52    63.00000  110.10000
   40    45    46    50.00000  112.30800
   40    45    55    70.00000  124.03900
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    52    53    70.00000  117.00000
   43    52    54    70.00000  117.00000
   49    33    37    70.00000  112.02700
   49    33    57    58.35000  112.70000
   49    43    44    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    43    44    35.00000  109.50000
   52    43    49    63.00000  111.10000
   54    52    53    80.00000  126.00000
   45    40    43    50.00000  121.00000
   45    55    56    35.00000  120.00000
   45    55    60    70.00000  123.01800
   55    45    46    35.00000  120.00000
   55    60    61    70.00000  123.01800
   55    60    71    70.00000  124.00000
   60    55    56    35.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    63    70.00000  123.01800
   60    71    69    70.00000  112.02700
   60    71    72    35.00000  109.50000
   60    71    73    35.00000  109.50000
   61    63    64    70.00000  124.03900
   61    63    66    70.00000  117.34000
   63    61    62    35.00000  120.00000
   63    64    65    35.00000  114.50000
   63    64    69    50.00000  121.00000
   63    66    67    65.00000  137.10300
   63    66    68    65.00000  137.10300
   64    69    70    35.00000  109.50000
   64    69    71    80.00000  111.61500
   64    69    74    63.00000  110.10000
   69    64    65    35.00000  112.50000
   69    71    72    37.50000  110.70000
   69    71    73    37.50000  110.70000
   69    74    75    70.00000  117.00000
   69    74    76    70.00000  117.00000
   71    60    61    70.00000  124.00000
   71    69    70    37.50000  110.70000
   73    71    72    33.00000  107.80000
   74    69    70    35.00000  109.50000
   74    69    71    63.00000  111.10000
   76    74    75    80.00000  126.00000
   66    63    64    70.00000  124.03900
   68    66    67    65.00000  121.00000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   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
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    57    47   0.56750  1.0 1.0
   29    33    57    47  -0.07550 -1.0 2.0
   29    33    57    47   0.20000  1.0 3.0
   29    33    57    58   0.15000  1.0 3.0
   29    33    57    59   0.15000  1.0 3.0
   29    33    49    43   0.44750  1.0 1.0
   29    33    49    43  -0.17800 -1.0 2.0
   29    33    49    43   0.20200  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.15000  1.0 3.0
   33    37    38    39   7.00000 -1.0 2.0
   33    37    38    41   7.00000 -1.0 2.0
   33    37   -40    43   1.00000 -1.0 2.0
   33    37    40    45   1.00000 -1.0 2.0
   37    33    57    47  -0.98800  1.0 1.0
   37    33    57    47   0.48800 -1.0 2.0
   37    33    57    47   0.76800  1.0 3.0
   37    33    57    58   0.15000  1.0 3.0
   37    33    57    59   0.15000  1.0 3.0
   37    33   -49    43   0.34400  1.0 1.0
   37    33   -49    43   0.09450 -1.0 2.0
   37    33   -49    43   0.11100  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    51   0.15000  1.0 3.0
   37    38    41    42   1.00000 -1.0 2.0
   37    38   -41    47   0.50400  1.0 1.0
   37    38   -41    47   1.60000 -1.0 2.0
   37    38   -41    47  -0.01800  1.0 3.0
   37    40    43    44   0.00000  1.0 1.0
   37    40   -43    49   0.25450  1.0 1.0
   37    40   -43    49  -0.61700 -1.0 2.0
   37    40   -43    49  -0.23550  1.0 3.0
   37    40    43    52  -0.12500  1.0 1.0
   37    40    43    52  -0.12500 -1.0 2.0
   37    40    43    52   0.25000  1.0 3.0
   37    40    45    46   0.00000  1.0 1.0
   37    40    45    55  -0.54500  1.0 1.0
   37    40    45    55   1.14150 -1.0 2.0
   38    37    40    43  -0.54700  1.0 1.0
   38    37    40    43   1.23000 -1.0 2.0
   38    37    40    45  -0.54500  1.0 1.0
   38    37    40    45   1.14150 -1.0 2.0
   38    41    47    48   0.03000  1.0 1.0
   38    41    47    48   0.58800 -1.0 2.0
   38    41    47    48   0.15550  1.0 3.0
   38    41    47    57   0.43900  1.0 1.0
   38    41    47    57  -0.18150 -1.0 2.0
   38    41    47    57  -0.03650  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    47   0.92800 -1.0 2.0
   41    47   -57    33   0.65300  1.0 1.0
   41    47   -57    33  -0.03850 -1.0 2.0
   41    47   -57    33   0.33900  1.0 3.0
   41    47    57    58   0.00000  1.0 1.0
   41    47    57    59   0.00000  1.0 1.0
   42    41    47    48   0.06100 -1.0 2.0
   42    41    47    57   0.49600 -1.0 2.0
   48    47    57    33   0.30150 -1.0 2.0
   48    47    57    58   0.00000  1.0 1.0
   48    47    57    59   0.00000  1.0 1.0
   57    33   -37    38   0.09850  1.0 1.0
   57    33   -37    38   0.15250 -1.0 2.0
   57    33   -37    38  -0.50650  1.0 3.0
   57    33    37    40  -0.93550  1.0 1.0
   57    33    37    40   0.38900 -1.0 2.0
   57    33    37    40   0.16950  1.0 3.0
   57    33    49    43   0.56750  1.0 1.0
   57    33    49    43  -0.07550 -1.0 2.0
   57    33    49    43   0.20000  1.0 3.0
   57    33    49    50   0.15000  1.0 3.0
   57    33    49    51   0.15000  1.0 3.0
   40    37    38    39   7.00000 -1.0 2.0
   40    37    38    41   7.00000 -1.0 2.0
   40    43   -49    33   1.26750  1.0 1.0
   40    43   -49    33  -0.00950 -1.0 2.0
   40    43   -49    33   0.30600  1.0 3.0
   40    43    49    50   0.22950  1.0 3.0
   40    43    49    51   0.22950  1.0 3.0
   40    43    52    53   0.00000  1.0 1.0
   40    43    52    54   0.00000  1.0 1.0
   40    45    55    56   7.00000 -1.0 2.0
   40    45    55    60   7.00000 -1.0 2.0
   43    40    45    46   0.00000  1.0 1.0
   43    40    45    55  -0.54700  1.0 1.0
   43    40    45    55   1.23000 -1.0 2.0
   44    43    49    33   0.15000  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    52    53   0.00000  1.0 1.0
   44    43    52    54   0.00000  1.0 1.0
   49    33    37    38   0.09850  1.0 1.0
   49    33    37    38   0.15250 -1.0 2.0
   49    33    37    38  -0.50650  1.0 3.0
   49    33   -37    40  -0.93550  1.0 1.0
   49    33   -37    40   0.38900 -1.0 2.0
   49    33   -37    40   0.16950  1.0 3.0
   49    33    57    47  -0.95700  1.0 1.0
   49    33    57    47  -0.18200 -1.0 2.0
   49    33    57    47   0.29450  1.0 3.0
   49    33    57    58   0.15000  1.0 3.0
   49    33    57    59   0.15000  1.0 3.0
   49    43    52    53   0.00000  1.0 1.0
   49    43    52    54   0.00000  1.0 1.0
   52    43    49    33  -0.84850  1.0 1.0
   52    43    49    33  -0.22800 -1.0 2.0
   52    43    49    33   0.29250  1.0 3.0
   52    43    49    50  -0.03800  1.0 3.0
   52    43    49    51  -0.03800  1.0 3.0
   45    40    43    44   0.00000  1.0 1.0
   45    40    43    49   0.25450  1.0 1.0
   45    40    43    49  -0.61700 -1.0 2.0
   45    40    43    49  -0.23550  1.0 3.0
   45    40    43    52  -0.12500  1.0 1.0
   45    40    43    52  -0.12500 -1.0 2.0
   45    40    43    52   0.25000  1.0 3.0
   45    55    60    61   0.28850  1.0 1.0
   45    55    60    61   2.61350 -1.0 2.0
   45    55    60    61   0.78400  1.0 3.0
   45    55    60    71  -0.18600  1.0 3.0
   46    45    55    56   7.00000 -1.0 2.0
   46    45    55    60   7.00000 -1.0 2.0
   55    60    61    62   7.00000 -1.0 2.0
   55    60    61    63   7.00000 -1.0 2.0
   55    60    71    69   0.98200  1.0 1.0
   55    60    71    69  -0.11900 -1.0 2.0
   55    60    71    69   0.24250  1.0 3.0
   55    60    71    72   0.00000  1.0 1.0
   55    60    71    73   0.00000  1.0 1.0
   56    55    60    61  -0.18600  1.0 3.0
   56    55    60    71   0.00000  1.0 1.0
   60    61    63    64  -0.18600  1.0 3.0
   60    61    63    66   0.28850  1.0 1.0
   60    61    63    66   2.61350 -1.0 2.0
   60    61    63    66   0.78400  1.0 3.0
   61    60    71    69   0.09850  1.0 1.0
   61    60    71    69   0.15250 -1.0 2.0
   61    60    71    69  -0.50650  1.0 3.0
   61    60    71    72   0.00000  1.0 1.0
   61    60    71    73   0.00000  1.0 1.0
   61    63    64    65   1.00000 -1.0 2.0
   61    63   -64    69  -0.54700  1.0 1.0
   61    63   -64    69   1.23000 -1.0 2.0
   61    63    66    67   7.00000 -1.0 2.0
   61    63    66    68   7.00000 -1.0 2.0
   62    61    63    64   0.00000  1.0 1.0
   62    61    63    66  -0.18600  1.0 3.0
   63    64    69    70   0.00000  1.0 1.0
   63    64    69    71   0.25450  1.0 1.0
   63    64    69    71  -0.61700 -1.0 2.0
   63    64    69    71  -0.23550  1.0 3.0
   63    64    69    74  -0.12500  1.0 1.0
   63    64    69    74  -0.12500 -1.0 2.0
   63    64    69    74   0.25000  1.0 3.0
   64    63    66    67   7.00000 -1.0 2.0
   64    63    66    68   7.00000 -1.0 2.0
   64    69   -71    60   0.21700  1.0 1.0
   64    69   -71    60   0.68550 -1.0 2.0
   64    69   -71    60  -0.27950  1.0 3.0
   64    69    71    72   0.22950  1.0 3.0
   64    69    71    73   0.22950  1.0 3.0
   64    69    74    75   0.00000  1.0 1.0
   64    69    74    76   0.00000  1.0 1.0
   65    64    69    70   0.00000  1.0 1.0
   65    64    69    71   0.00000  1.0 1.0
   65    64    69    74   0.00000  1.0 1.0
   70    69    71    60   0.15000  1.0 3.0
   70    69    71    72   0.15000  1.0 3.0
   70    69    71    73   0.15000  1.0 3.0
   70    69    74    75   0.00000  1.0 1.0
   70    69    74    76   0.00000  1.0 1.0
   71    60    61    62   7.00000 -1.0 2.0
   71    60   -61    63   7.00000 -1.0 2.0
   71    69    74    75   0.00000  1.0 1.0
   71    69    74    76   0.00000  1.0 1.0
   74    69    71    60  -0.98800  1.0 1.0
   74    69    71    60   0.48800 -1.0 2.0
   74    69    71    60   0.76800  1.0 3.0
   74    69    71    72  -0.03800  1.0 3.0
   74    69    71    73  -0.03800  1.0 3.0
   66    63    64    65   1.00000 -1.0 2.0
   66    63    64    69  -0.54700  1.0 1.0
   66    63    64    69   1.23000 -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
   33    40    37    38   1.10000 -1.0 2.0
   41    39    38    37   1.10000 -1.0 2.0
   38    47    41    42  10.50000 -1.0 2.0
   41    57    47    48  10.50000 -1.0 2.0
   43    37    40    45   1.00000 -1.0 2.0
   53    43    52    54  10.50000 -1.0 2.0
   40    46    45    55  15.00000 -1.0 2.0
   60    56    55    45  15.00000 -1.0 2.0
   55    71    60    61   1.10000 -1.0 2.0
   63    62    61    60   1.10000 -1.0 2.0
   61    64    63    66   1.10000 -1.0 2.0
   65    63    64    69   1.00000 -1.0 2.0
   75    69    74    76  10.50000 -1.0 2.0
   67    68    66    63   1.10000 -1.0 2.0
END
