* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    137    217     403
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02068   101.20168   -45.95743
    3     1 S   H    _H1_     3     1.02022    75.84068    60.74619
    4     1 S   H    _H2_     4     1.02178    38.75154  -151.91371
    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     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   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     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   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   CA   _C18    36     1.76488    99.64963   179.97202
   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   _C13    37     1.39373   119.49405    89.99736
   38    37 S   CA   _C14    38     1.39477   120.03086   179.94065
   39    38 S   HA   _H19    39     1.08860   120.39972  -179.97202
   40    37 S   CA   _C11    46     1.46025   123.19359    -0.05234
   41    38 S   CA   _C15    40     1.39539   119.98970     0.00000
   42    41 S   Cl   Cl2_    41     1.72091   120.03267  -179.98022
   43    40 S   CA   _C12    47     1.36648   122.18333    89.98021
   44    41 S   CA   _C16    42     1.39536   119.96610    -0.04423
   45    44 S   HA   _H20    43     1.08843   119.72020   180.00000
   46    43 S   NB   _N7_    48     1.39468   124.17037  -179.98022
   47    43 S   NE   _N8_    73     1.38451   119.14330     0.05234
   48    47 S   H    _H17    74     0.98739   117.61145    -0.02798
   49    47 S   H    _H18    75     0.98698   117.57588  -179.95577
   50    33 S   CA   _C17    44     1.39496   120.49122   -90.03182
   51    50 S   Cl   Cl1_    45     1.73230   123.12932     0.03956
   52    46 S   CQ   _C9_    49     1.29774   122.13907    -0.02798
   53    52 S   NAP  _N6_    50     1.54773   120.37489     0.01978
   54    53 S   H    _H15    51     1.01914   120.87385   180.00000
   55    52 S   NE   _N5_    54     1.35549   124.48675  -179.97202
   56    40 S   CA   _C10    52     1.47443   116.86713   -89.99042
   57    56 S   HA   _H16    53     1.09694   120.62913     0.02798
   58    55 S   CT   _C6_    55     1.45691   121.73762   149.98686
   59    58 S   HC   _H9_    56     1.09791   108.66315   108.07516
   60    58 S   HC   _H10    57     1.09685   111.31271    -9.25686
   61    58 S   CT   _C5_    58     1.52120   111.01126  -130.60517
   62    61 S   HC   _H7_    59     1.09605   111.84404    65.16344
   63    61 S   HC   _H8_    60     1.09538   110.96826  -171.90566
   64    61 S   NP   _N4_    61     1.51421   109.08081   -53.42022
   65    64 S   H    _H6_    62     1.02908   107.37715   -59.18838
   66    64 S   CT   _C8_    63     1.51377   111.60330    58.27973
   67    66 S   HC   _H13    64     1.09445   107.62803  -178.76457
   68    66 S   HC   _H14    65     1.09606   107.35249    63.08964
   69    64 S   CT   _C4_    69     1.50228   111.80266  -175.65724
   70    69 S   HC   _H3_    70     1.09192   107.81517   -62.93244
   71    69 S   HC   _H4_    71     1.09184   107.86434    57.01862
   72    69 S   HC   _H5_    72     1.09169   107.86303   177.04899
   73    55 S   CT   _C7_    66     1.45715   121.69829   -33.76393
   74    73 S   HC   _H11    67     1.09691   111.32161     9.22957
   75    73 S   HC   _H12    68     1.09774   108.63909  -107.99890
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  11   2   1   1  14   9   4  12   5   3   9   3   2  10   4   1
   1   1   1  13   6   3  14   1   1  12   6   5  12   5   4  11
   8   9   5   4   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    50    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    50    51    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    44    45    50    51    40    43    56  
   35    36  
   36  
    0  
   38    39    41    42    44    50    51    40    43    46    53    56    57    47  
   39    41    42    44    45    50    40    43    56  
   41    42    44    40  
   43    46    52    53    54    56    57    47    48    49    41    50  
   42    44    45    50    51  
   44    45    50  
   46    52    53    56    57    55    47    48    49  
   45    50    51  
   50    51  
   52    53    54    56    55    58    73    47    48    49  
   48    49    52    56  
   49  
    0  
   51  
    0  
   53    54    56    57    55    58    59    60    61    66    73    74    75  
   54    56    57    55    58    73  
   56    57    55  
   58    59    60    61    62    63    64    66    67    68    73    74    75    56  
   57  
    0  
   59    60    61    62    63    64    65    66    73    74    75    69  
   60    61    62    63    64    73  
   61    62    63    64    73  
   62    63    64    65    66    67    68    73    69    70    71    72  
   63    64    65    66    69  
   64    65    66    69  
   65    66    67    68    73    74    75    69    70    71    72  
   66    67    68    73    69    70    71    72  
   67    68    73    74    75    69    70    71    72  
   68    73    74    75    69  
   73    74    75    69  
   70    71    72    73  
   71    72  
   72  
    0  
   74    75  
   75  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.320000   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   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   39   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   40   3.5500   0.0700  -0.378800   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5500   0.0700   1.022800   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.2800   0.1700  -0.709200   1.8650   1.6500   0.001000000  -0.511443539
   47   3.3000   0.1700  -0.920000   1.8650   1.6500   0.051222218  -2.220205820
   48   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   49   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   52   3.5500   0.0700   1.021200   2.0020   1.7750   0.001000000  -0.843144165
   53   3.2500   0.1700  -1.134900   1.9750   1.7500   0.001000000  -0.511443539
   54   0.0000   0.0000   0.431900   0.9960   0.8600   0.030040813  -0.651083722
   55   3.3000   0.1700  -0.120000   1.9050   1.6860   0.051222218  -2.220205820
   56   3.5500   0.0700   0.505300   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.141700   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   65   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   75   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   250.000  1.760
   33    37   469.000  1.400
   33    50   469.000  1.400
   37    38   469.000  1.400
   37    40   375.000  1.464
   38    39   367.000  1.080
   38    41   469.000  1.400
   41    42   300.000  1.725
   41    44   469.000  1.400
   44    45   367.000  1.080
   44    50   469.000  1.400
   50    51   300.000  1.725
   40    43   469.000  1.400
   40    56   469.000  1.400
   43    46   483.000  1.339
   43    47   481.000  1.340
   46    52   502.000  1.324
   52    53   535.000  1.326
   52    55   410.000  1.375
   53    54   475.000  1.020
   53    56   485.000  1.342
   56    57   367.000  1.080
   55    58   382.000  1.448
   55    73   382.000  1.448
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   367.000  1.471
   64    65   434.000  1.010
   64    66   367.000  1.471
   64    69   367.000  1.471
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   47    48   434.000  1.010
   47    49   434.000  1.010
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  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    50    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    40    60.00000  122.76000
   33    50    44    63.00000  120.00000
   33    50    51    75.00000  120.00000
   37    38    39    35.00000  120.00000
   37    38    41    63.00000  120.00000
   37    40    43    60.00000  122.76000
   37    40    56    60.00000  122.76000
   38    41    42    75.00000  120.00000
   38    41    44    63.00000  120.00000
   41    38    39    35.00000  120.00000
   41    44    45    35.00000  120.00000
   41    44    50    63.00000  120.00000
   44    41    42    75.00000  120.00000
   44    50    51    75.00000  120.00000
   50    33    37    63.00000  120.00000
   50    44    45    35.00000  120.00000
   40    37    38    60.00000  122.76000
   40    43    46    70.00000  124.00000
   40    43    47    70.00000  120.10000
   40    56    53    70.00000  119.29800
   40    56    57    35.00000  120.00000
   43    46    52    70.00000  118.60000
   43    47    48    35.00000  113.50000
   43    47    49    35.00000  113.50000
   46    52    53    80.00000  118.80000
   46    52    55    85.00000  116.09700
   52    53    54    45.00000  118.71300
   52    53    56    80.00000  116.44700
   52    55    58    50.00000  123.00000
   52    55    73    50.00000  123.00000
   53    56    57    45.00000  112.84900
   56    40    43    63.00000  120.00000
   56    53    54    45.00000  117.56800
   55    52    53    85.00000  116.09700
   55    58    59    35.00000  109.50000
   55    58    60    35.00000  109.50000
   55    58    61    80.00000  111.61500
   55    73    66    80.00000  111.61500
   55    73    74    35.00000  109.50000
   55    73    75    35.00000  109.50000
   58    61    62    37.50000  110.70000
   58    61    63    37.50000  110.70000
   58    61    64    80.00000  111.20000
   60    58    59    33.00000  107.80000
   61    58    59    37.50000  110.70000
   61    58    60    37.50000  110.70000
   61    64    65    35.00000  109.50000
   61    64    66    75.00000  113.01200
   61    64    69    75.00000  113.01200
   63    61    62    33.00000  107.80000
   64    61    62    35.00000  109.50000
   64    61    63    35.00000  109.50000
   64    66    67    35.00000  109.50000
   64    66    68    35.00000  109.50000
   64    66    73    80.00000  111.20000
   64    69    70    35.00000  109.50000
   64    69    71    35.00000  109.50000
   64    69    72    35.00000  109.50000
   66    64    65    35.00000  109.50000
   66    73    74    37.50000  110.70000
   66    73    75    37.50000  110.70000
   68    66    67    33.00000  107.80000
   73    55    58    50.00000  115.00000
   73    66    67    37.50000  110.70000
   73    66    68    37.50000  110.70000
   75    73    74    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    66    75.00000  113.01200
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   47    43    46    80.00000  117.25000
   49    47    48    35.00000  109.00000
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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    50   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    40   3.62500 -1.0 2.0
   29    33    50    44   3.62500 -1.0 2.0
   29    33    50    51   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    41   3.62500 -1.0 2.0
   33    37    40    43  -0.19450  1.0 1.0
   33    37    40    43   0.63300 -1.0 2.0
   33    37    40    43   0.07450  1.0 3.0
   33    37    40    56  -0.19450  1.0 1.0
   33    37    40    56   0.63300 -1.0 2.0
   33    37    40    56   0.07450  1.0 3.0
   37    33    50    44   3.62500 -1.0 2.0
   37    33    50    51   3.62500 -1.0 2.0
   37    38    41    42   3.62500 -1.0 2.0
   37    38   -41    44   3.62500 -1.0 2.0
   37    40    43    46   3.62500 -1.0 2.0
   37    40    43    47   3.62500 -1.0 2.0
   37    40    56    53   3.62500 -1.0 2.0
   37    40    56    57   3.62500 -1.0 2.0
   38    37    40    43  -0.19450  1.0 1.0
   38    37    40    43   0.63300 -1.0 2.0
   38    37    40    43   0.07450  1.0 3.0
   38    37    40    56  -0.19450  1.0 1.0
   38    37    40    56   0.63300 -1.0 2.0
   38    37    40    56   0.07450  1.0 3.0
   38    41    44    45   3.62500 -1.0 2.0
   38    41    44    50   3.62500 -1.0 2.0
   39    38    41    42   3.62500 -1.0 2.0
   39    38    41    44   3.62500 -1.0 2.0
   41    44   -50    33   3.62500 -1.0 2.0
   41    44    50    51   3.62500 -1.0 2.0
   42    41    44    45   3.62500 -1.0 2.0
   42    41    44    50   3.62500 -1.0 2.0
   45    44    50    33   3.62500 -1.0 2.0
   45    44    50    51   3.62500 -1.0 2.0
   50    33   -37    38   3.62500 -1.0 2.0
   50    33    37    40   3.62500 -1.0 2.0
   40    37    38    39   3.62500 -1.0 2.0
   40    37    38    41   3.62500 -1.0 2.0
   40    43    46    52   3.62500 -1.0 2.0
   40    43    47    48   1.00000 -1.0 2.0
   40    43    47    49   1.00000 -1.0 2.0
   43    40    56    53   3.62500 -1.0 2.0
   43    40    56    57   3.62500 -1.0 2.0
   43    46   -52    53   3.62500 -1.0 2.0
   43    46    52    55   3.62500 -1.0 2.0
   46    43    47    48   1.75000 -1.0 2.0
   46    43    47    49   1.75000 -1.0 2.0
   46    52    53    54   3.62500 -1.0 2.0
   46    52    53    56   3.62500 -1.0 2.0
   46    52    55    58  -1.10000  1.0 1.0
   46    52    55    58   1.25000 -1.0 2.0
   46    52    55    73  -1.10000  1.0 1.0
   46    52    55    73   1.25000 -1.0 2.0
   52    53   -56    40   3.62500 -1.0 2.0
   52    53    56    57   3.62500 -1.0 2.0
   52    55    58    59   0.00000  1.0 1.0
   52    55    58    60   0.00000  1.0 1.0
   52    55    58    61   0.92500  1.0 1.0
   52    55    58    61   0.12150 -1.0 2.0
   52    55    58    61  -0.25000  1.0 3.0
   52    55    73    66   0.92500  1.0 1.0
   52    55    73    66   0.12150 -1.0 2.0
   52    55    73    66  -0.25000  1.0 3.0
   52    55    73    74   0.00000  1.0 1.0
   52    55    73    75   0.00000  1.0 1.0
   53    52    55    58  -1.10000  1.0 1.0
   53    52    55    58   1.25000 -1.0 2.0
   53    52    55    73  -1.10000  1.0 1.0
   53    52    55    73   1.25000 -1.0 2.0
   54    53    56    40   3.62500 -1.0 2.0
   54    53    56    57   3.62500 -1.0 2.0
   56    40   -43    46   3.62500 -1.0 2.0
   56    40    43    47   3.62500 -1.0 2.0
   55    52    53    54   3.62500 -1.0 2.0
   55    52    53    56   3.62500 -1.0 2.0
   55    58    61    62   0.22950  1.0 3.0
   55    58    61    63   0.22950  1.0 3.0
   55    58    61    64   2.45700  1.0 1.0
   55    58    61    64   1.17300 -1.0 2.0
   58    55    73    66   0.00000  1.0 1.0
   58    55    73    74   0.00000  1.0 1.0
   58    55    73    75   0.00000  1.0 1.0
   58    61    64    65   0.17350  1.0 3.0
   58    61   -64    66   0.47100  1.0 1.0
   58    61    64    69   0.47100  1.0 1.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    63   0.15000  1.0 3.0
   59    58    61    64   0.19200  1.0 3.0
   60    58    61    62   0.15000  1.0 3.0
   60    58    61    63   0.15000  1.0 3.0
   60    58    61    64   0.19200  1.0 3.0
   61    64    66    67   0.15000  1.0 3.0
   61    64    66    68   0.15000  1.0 3.0
   61    64    66    73   0.47100  1.0 1.0
   61    64    69    70   0.15000  1.0 3.0
   61    64    69    71   0.15000  1.0 3.0
   61    64    69    72   0.15000  1.0 3.0
   62    61    64    65   0.13050  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    69   0.15000  1.0 3.0
   63    61    64    65   0.13050  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   63    61    64    69   0.15000  1.0 3.0
   64    66   -73    55   2.45700  1.0 1.0
   64    66   -73    55   1.17300 -1.0 2.0
   64    66    73    74   0.19200  1.0 3.0
   64    66    73    75   0.19200  1.0 3.0
   65    64    66    67   0.13050  1.0 3.0
   65    64    66    68   0.13050  1.0 3.0
   65    64    66    73   0.17350  1.0 3.0
   65    64    69    70   0.13050  1.0 3.0
   65    64    69    71   0.13050  1.0 3.0
   65    64    69    72   0.13050  1.0 3.0
   66    64    69    70   0.15000  1.0 3.0
   66    64    69    71   0.15000  1.0 3.0
   66    64    69    72   0.15000  1.0 3.0
   67    66    73    55   0.22950  1.0 3.0
   67    66    73    74   0.15000  1.0 3.0
   67    66    73    75   0.15000  1.0 3.0
   68    66    73    55   0.22950  1.0 3.0
   68    66    73    74   0.15000  1.0 3.0
   68    66    73    75   0.15000  1.0 3.0
   73    55    58    59   0.00000  1.0 1.0
   73    55    58    60   0.00000  1.0 1.0
   73    55   -58    61   0.00000  1.0 1.0
   69    64    66    67   0.15000  1.0 3.0
   69    64    66    68   0.15000  1.0 3.0
   69    64    66    73   0.47100  1.0 1.0
   47    43    46    52   3.62500 -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
   37    50    33    29   4.00000 -1.0 2.0
   38    40    37    33   4.00000 -1.0 2.0
   41    39    38    37   1.10000 -1.0 2.0
   44    42    41    38   4.00000 -1.0 2.0
   50    45    44    41   1.10000 -1.0 2.0
   44    51    50    33   4.00000 -1.0 2.0
   43    56    40    37   4.00000 -1.0 2.0
   46    47    43    40   4.00000 -1.0 2.0
   53    55    52    46   4.00000 -1.0 2.0
   54    52    53    56   1.00000 -1.0 2.0
   53    57    56    40   1.10000 -1.0 2.0
   73    52    55    58   1.00000 -1.0 2.0
   49    43    47    48   1.00000 -1.0 2.0
END
