* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    137    220     398
    1     0 S   NP   _N1_     1    28.64611    96.05246   -22.73892
    2     1 S   H    _HN1     2     1.02828    36.39590   159.96533
    3     1 S   H    _H1_     3     1.02783   100.58250   -94.17020
    4     1 S   H    _H2_     4     1.02950    76.13500    12.33016
    5     1 S   CT   _CA1     5     1.50118   141.34429   117.75404
    6     5 S   HC   _HA1     6     1.09573   105.19123    84.45568
    7     5 S   CO3  _C1_     7     1.53785   112.45645   -35.75580
    8     7 S   O2Z  _O11     8     1.26371   115.00497   -42.49193
    9     7 S   O2Z  _O12     9     1.26241   114.94702   136.61563
   10     5 S   CT   _CB1    10     1.53078   107.41655  -157.58102
   11    10 S   HC   HB11    11     1.09832   109.34888   -49.87519
   12    10 S   HC   HB12    12     1.09812   110.45408    66.72599
   13    10 S   CT   _CG1    13     1.52989   112.61526  -170.86718
   14    13 S   HC   HG11    14     1.09583   110.61093   -65.82443
   15    13 S   HC   HG12    15     1.09671   109.79797    53.40329
   16    13 S   C    _CD1    16     1.51805   112.24539   173.82695
   17    16 S   O    _OE1    17     1.22727   123.28596     6.25476
   18    16 S   N    _N2_    18     1.38655   111.65238  -173.76200
   19    18 S   H    _HN2    19     1.01574   118.92536     1.66342
   20    18 S   CT1  _CA2    20     1.46203   123.40394   177.40610
   21    20 S   HC   _HA2    21     1.09746   109.40409     2.63522
   22    20 S   C    _C2_    22     1.53584   108.52332  -112.82837
   23    22 S   O    _O2_    23     1.23061   122.30552  -147.50669
   24    20 S   CT   _CB2    32     1.53514   111.67240   124.69927
   25    24 S   HC   HB21    33     1.09496   109.61401    55.83249
   26    24 S   HC   HB22    34     1.09234   109.41547   174.62291
   27    22 S   N    _N3_    24     1.38339   113.70843    39.84113
   28    27 S   H    _HN3    25     1.01582   119.58185    -3.09573
   29    24 S   S    _SG2    35     1.82949   111.08883   -64.60707
   30    27 S   CT   _CA3    26     1.45286   123.20399   177.19244
   31    30 S   HC   HA31    27     1.09549   107.47555   -65.47291
   32    30 S   HC   HA32    28     1.09558   108.02095    50.96376
   33    29 S   CT   _C5_    36     1.88020   102.83161  -169.55015
   34    30 S   CO3  _C3_    29     1.52960   114.10323   172.99714
   35    34 S   O2Z  _O31    30     1.26375   116.08755    -0.54644
   36    34 S   O2Z  _O32    31     1.26436   114.40820   179.52895
   37    33 S   CT   _C6_    37     1.56529   109.85589    65.43048
   38    37 S   HC   _H12    38     1.09760   109.28861   -68.80538
   39    37 S   HC   _H13    39     1.09140   107.30552   178.87117
   40    33 S   CT   _C14    63     1.58096   106.40443  -172.31010
   41    40 S   HC   _H8_    64     1.09343   109.38146   -67.13154
   42    33 S   CT   _C4_    68     1.54255   108.56961   -53.35031
   43    42 S   HC   _H9_    69     1.09498   112.39776   -55.57013
   44    42 S   HC   _H10    70     1.09563   110.98844  -176.09385
   45    42 S   HC   _H11    71     1.09505   112.10688    66.08978
   46    37 S   CT   _C7_    40     1.54703   116.70740    54.28883
   47    46 S   HC   _H3_    41     1.09489   111.21858    24.62706
   48    40 S   OH   _O33    65     1.43906   110.66204    47.56712
   49    48 S   HO   _H15    66     0.97111   108.47887    59.62573
   50    46 S   CT   _C8_    42     1.53915   114.42141   151.70450
   51    50 S   HC   _H4_    43     1.10069   108.44199    44.08178
   52    50 S   CM   _C16    44     1.49618    98.70684   153.96328
   53    50 S   CT   _C9_    51     1.55253   116.49413   -79.35088
   54    53 S   HC   _H5_    52     1.09282   113.64839  -131.34624
   55    52 S   CO4  _C18    45     1.48149   107.92209   -27.59385
   56    55 S   O    _O37    46     1.21718   127.18584  -167.41944
   57    52 S   CM   _C17    48     1.33580   131.12924   152.37141
   58    57 S   HC   _H16    49     1.08389   121.76779     0.92047
   59    57 S   HC   _H17    50     1.08576   121.47374  -179.88465
   60    53 S   CM   _C10    53     1.47984   114.62269    -2.69573
   61    60 S   HC   _H14    54     1.08164   123.19189   -67.87897
   62    46 S   OS   _O38    47     1.44346   109.48466   -91.76490
   63    60 S   CM   _C11    55     1.33323   111.51636   100.65675
   64    63 S   CO4  _C15    56     1.47855   105.21419    11.63527
   65    64 S   O    _O35    57     1.21896   125.28758   176.86756
   66    63 S   C3T  _C12    59     1.45205   129.96187  -162.57787
   67    66 S   HC   _H6_    60     1.08674   112.65355  -156.08790
   68    53 S   OS   _O36    58     1.43761   107.29054   110.55388
   69    66 S   C3T  _C13    61     1.53329   118.41921    63.98329
   70    69 S   HC   _H7_    62     1.08447   116.34986   136.92603
   71    66 S   O3T  _O34    67     1.42455   126.16783    -5.95875
  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  13   5   4   3
  19   2   1   1  18   7   6  14   7   6   2   1   1  12   6   5
   1  15   8  10  11   5   5   2   3   1   1   9   4   1   8   6
   2   5   3   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    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46    69    40    41    48    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    50    62    66    69    70    40    41    48    49    71    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    50    51    52    55    62    53    69    40    41    48    42    43    44    45  
   39    46    47    50    62    40    42  
   46    47    50    62    40    42  
   41    48    49    71    42    43    44    45    46    63    66    67    69    70  
   48    49    71    42    66    69    70  
   43    44    45    46    48    69  
   44    45  
   45  
    0  
   47    50    51    52    55    56    62    57    53    54    60    68  
   50    51    52    55    62    53  
   49    71    66    69    70  
   69  
   51    52    55    56    62    57    58    59    53    54    60    61    63    64    68  
   52    55    62    57    53    54    60    68  
   55    56    62    57    58    59    53    54    60    68  
   54    60    61    63    64    65    68    66    55    57    62  
   60    61    63    64    68  
   56    62    57    58    59  
   62    57  
   58    59    62  
   59  
    0  
   61    63    64    65    68    66    67    69    71  
   63    64    68    66  
    0  
   64    65    68    66    67    69    70    71  
   65    68    66    67    69    71  
   68    66  
   67    69    70    71    68  
   69    70    71  
    0  
   70    71  
   71  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    40   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    46   268.000  1.529
   46    47   340.000  1.090
   46    50   268.000  1.529
   46    62   320.000  1.410
   50    51   340.000  1.090
   50    52   317.000  1.510
   50    53   268.000  1.529
   52    55   320.000  1.462
   52    57   549.000  1.340
   55    56   570.000  1.229
   55    62   214.000  1.327
   57    58   340.000  1.080
   57    59   340.000  1.080
   53    54   340.000  1.090
   53    60   317.000  1.510
   53    68   320.000  1.410
   60    61   340.000  1.080
   60    63   549.000  1.340
   63    64   320.000  1.462
   63    66   305.000  1.480
   64    65   570.000  1.229
   64    68   214.000  1.327
   66    67   340.000  1.088
   66    69   260.000  1.509
   66    71   335.000  1.432
   69    70   340.000  1.088
   69    40   275.000  1.510
   69    71   335.000  1.432
   40    41   340.000  1.090
   40    48   320.000  1.410
   48    49   553.000  0.945
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    46    58.35000  112.70000
   33    40    69    70.00000  112.37300
   33    40    41    37.50000  110.70000
   33    40    48    50.00000  109.50000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    37.50000  110.70000
   37    46    50    58.35000  112.70000
   37    46    62    50.00000  109.50000
   39    37    38    33.00000  107.80000
   46    37    38    37.50000  110.70000
   46    37    39    37.50000  110.70000
   46    50    51    37.50000  110.70000
   46    50    52    70.00000  112.02700
   46    50    53    58.35000  112.70000
   46    62    55    83.00000  116.90000
   50    46    47    37.50000  110.70000
   50    52    55    65.00000  116.34900
   50    52    57    70.00000  124.00000
   50    53    54    37.50000  110.70000
   50    53    60    70.00000  112.02700
   50    53    68    50.00000  109.50000
   52    50    51    35.00000  109.50000
   52    55    56    80.00000  123.72100
   52    55    62    90.00000  111.29400
   52    57    58    35.00000  120.00000
   52    57    59    35.00000  120.00000
   62    46    47    35.00000  109.50000
   62    46    50    50.00000  109.50000
   62    55    56    83.00000  123.40000
   57    52    55    65.00000  118.96000
   59    57    58    35.00000  117.00000
   53    50    51    37.50000  110.70000
   53    50    52    70.00000  112.02700
   53    60    61    35.00000  117.00000
   53    60    63    70.00000  124.00000
   53    68    64    83.00000  116.90000
   60    53    54    35.00000  109.50000
   60    63    64    65.00000  118.96000
   60    63    66    55.00000  125.06700
   63    60    61    35.00000  120.00000
   63    64    65    80.00000  123.72100
   63    64    68    90.00000  111.29400
   63    66    67    40.00000  112.45000
   63    66    69    60.00000  120.58800
   63    66    71    85.00000  114.23300
   68    53    54    35.00000  109.50000
   68    53    60    85.00000  110.90400
   68    64    65    83.00000  123.40000
   66    63    64    65.00000  114.68000
   66    69    70    37.50000  117.20000
   66    69    40    60.00000  120.94000
   66    69    71    15.00000   60.43100
   66    71    69    15.00000   59.14900
   69    66    67    37.50000  117.20000
   69    40    41    45.00000  109.38400
   69    40    48    50.00000  109.50000
   40    33    37    58.35000  112.70000
   40    69    70    40.00000  115.04500
   40    48    49    55.00000  108.50000
   48    40    41    35.00000  109.50000
   71    66    67    50.00000  114.27700
   71    66    69    15.00000   60.43100
   71    69    70    50.00000  114.27700
   71    69    40    80.00000  116.47100
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    46   0.44750  1.0 1.0
   29    33    37    46  -0.17800 -1.0 2.0
   29    33    37    46   0.20200  1.0 3.0
   29    33    40    69   0.44750  1.0 1.0
   29    33    40    69  -0.17800 -1.0 2.0
   29    33    40    69   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    48   0.56750  1.0 1.0
   29    33    40    48  -0.07550 -1.0 2.0
   29    33    40    48   0.20000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   0.15000  1.0 3.0
   33    37    46    50   0.56750  1.0 1.0
   33    37    46    50  -0.07550 -1.0 2.0
   33    37    46    50   0.20000  1.0 3.0
   33    37    46    62   0.62750  1.0 1.0
   33    37    46    62  -0.30950 -1.0 2.0
   33    37    46    62   0.27300  1.0 3.0
   33    40    48    49  -0.11600  1.0 1.0
   33    40    48    49  -0.09450 -1.0 2.0
   33    40    48    49   0.21250  1.0 3.0
   37    33    40    69   0.47050  1.0 1.0
   37    33    40    69   0.03900 -1.0 2.0
   37    33    40    69   0.20100  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    48   0.86500  1.0 1.0
   37    33    40    48  -0.17500 -1.0 2.0
   37    33    40    48   0.20800  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    45   0.15000  1.0 3.0
   37    46    50    51   0.15000  1.0 3.0
   37    46    50    52   0.34400  1.0 1.0
   37    46    50    52   0.09450 -1.0 2.0
   37    46    50    52   0.11100  1.0 3.0
   37    46    50    53   0.56750  1.0 1.0
   37    46    50    53  -0.07550 -1.0 2.0
   37    46    50    53   0.20000  1.0 3.0
   37    46    62    55  -0.25900  1.0 1.0
   37    46    62    55  -0.47000 -1.0 2.0
   37    46    62    55   0.11750  1.0 3.0
   38    37    46    47   0.15000  1.0 3.0
   38    37    46    50   0.15000  1.0 3.0
   38    37    46    62   0.23400  1.0 3.0
   39    37    46    47   0.15000  1.0 3.0
   39    37    46    50   0.15000  1.0 3.0
   39    37    46    62   0.23400  1.0 3.0
   46    50   -52    55   0.09700  1.0 1.0
   46    50   -52    55   0.15600 -1.0 2.0
   46    50   -52    55  -0.50800  1.0 3.0
   46    50    52    57   0.09850  1.0 1.0
   46    50    52    57   0.15250 -1.0 2.0
   46    50    52    57  -0.50650  1.0 3.0
   46    50    53    54   0.15000  1.0 3.0
   46    50    53    60   0.34400  1.0 1.0
   46    50    53    60   0.09450 -1.0 2.0
   46    50    53    60   0.11100  1.0 3.0
   46    50    53    68   0.62750  1.0 1.0
   46    50    53    68  -0.30950 -1.0 2.0
   46    50    53    68   0.27300  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    52   0.15000  1.0 3.0
   47    46    50    53   0.15000  1.0 3.0
   47    46    62    55   0.08050  1.0 3.0
   50    46   -62    55  -0.25900  1.0 1.0
   50    46   -62    55  -0.47000 -1.0 2.0
   50    46   -62    55   0.11750  1.0 3.0
   50    52    55    56  -0.64400  1.0 1.0
   50    52    55    56   0.26850 -1.0 2.0
   50    52   -55    62  -0.15000  1.0 1.0
   50    52   -55    62   0.89550 -1.0 2.0
   50    52   -55    62  -0.06900  1.0 3.0
   50    52    57    58   7.00000 -1.0 2.0
   50    52    57    59   7.00000 -1.0 2.0
   50    53    60    61   0.00000  1.0 1.0
   50    53    60    63   0.09850  1.0 1.0
   50    53    60    63   0.15250 -1.0 2.0
   50    53    60    63  -0.50650  1.0 3.0
   50    53    68    64  -0.25900  1.0 1.0
   50    53    68    64  -0.47000 -1.0 2.0
   50    53    68    64   0.11750  1.0 3.0
   51    50    52    55   0.15000  1.0 3.0
   51    50    52    57   0.00000  1.0 1.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    60   0.15000  1.0 3.0
   51    50    53    68   0.23400  1.0 3.0
   52    50    53    54   0.15000  1.0 3.0
   52    50    53    60   0.31000  1.0 1.0
   52    50    53    60   0.14700 -1.0 2.0
   52    50    53    60   0.07550  1.0 3.0
   52    50    53    68   0.61850  1.0 1.0
   52    50    53    68  -0.22750 -1.0 2.0
   52    50    53    68   0.15300  1.0 3.0
   52    55   -62    46   2.00000 -1.0 2.0
   55    52    57    58   7.00000 -1.0 2.0
   55    52    57    59   7.00000 -1.0 2.0
   56    55    62    46   3.00000 -1.0 2.0
   62    46    50    51   0.23400  1.0 3.0
   62    46   -50    52   0.61850  1.0 1.0
   62    46   -50    52  -0.22750 -1.0 2.0
   62    46   -50    52   0.15300  1.0 3.0
   62    46    50    53   0.62750  1.0 1.0
   62    46    50    53  -0.30950 -1.0 2.0
   62    46    50    53   0.27300  1.0 3.0
   57    52    55    56   1.00000 -1.0 2.0
   57    52    55    62  -0.56150  1.0 1.0
   57    52    55    62   2.19150 -1.0 2.0
   53    50    52    55   0.09700  1.0 1.0
   53    50    52    55   0.15600 -1.0 2.0
   53    50    52    55  -0.50800  1.0 3.0
   53    50    52    57   0.09850  1.0 1.0
   53    50    52    57   0.15250 -1.0 2.0
   53    50    52    57  -0.50650  1.0 3.0
   53    60   -63    64   7.00000 -1.0 2.0
   53    60    63    66   7.00000 -1.0 2.0
   54    53    60    61   0.33100  1.0 3.0
   54    53    60    63   0.00000  1.0 1.0
   54    53    68    64   0.08050  1.0 3.0
   60    53   -68    64  -0.82050  1.0 1.0
   60    53   -68    64   0.00600 -1.0 2.0
   60    53   -68    64   0.04400  1.0 3.0
   60    63    64    65   1.00000 -1.0 2.0
   60    63   -64    68  -0.56150  1.0 1.0
   60    63   -64    68   2.19150 -1.0 2.0
   60    63    66    67   0.00000  1.0 1.0
   60    63    66    69   0.09850  1.0 1.0
   60    63    66    69   0.15250 -1.0 2.0
   60    63    66    69  -0.50650  1.0 3.0
   60    63    66    71   0.39000  1.0 1.0
   60    63    66    71  -0.05800 -1.0 2.0
   60    63    66    71  -0.55150  1.0 3.0
   61    60    63    64   7.00000 -1.0 2.0
   61    60    63    66   7.00000 -1.0 2.0
   63    64   -68    53   2.00000 -1.0 2.0
   63    66    69    70   0.15000  1.0 3.0
   63    66    69    40   0.34400  1.0 1.0
   63    66    69    40   0.09450 -1.0 2.0
   63    66    69    40   0.11100  1.0 3.0
   63    66   -69    71   0.61850  1.0 1.0
   63    66   -69    71  -0.22750 -1.0 2.0
   63    66   -69    71   0.15300  1.0 3.0
   63    66   -71    69  -0.77900  1.0 1.0
   63    66   -71    69  -0.36900 -1.0 2.0
   63    66   -71    69   0.40400  1.0 3.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    69   0.09700  1.0 1.0
   64    63    66    69   0.15600 -1.0 2.0
   64    63    66    69  -0.50800  1.0 3.0
   64    63    66    71   0.09700  1.0 1.0
   64    63    66    71   0.15600 -1.0 2.0
   64    63    66    71  -0.50800  1.0 3.0
   65    64    68    53   3.00000 -1.0 2.0
   68    53    60    61   0.00000  1.0 1.0
   68    53   -60    63   0.39000  1.0 1.0
   68    53   -60    63  -0.05800 -1.0 2.0
   68    53   -60    63  -0.55150  1.0 3.0
   66    63    64    65  -0.64400  1.0 1.0
   66    63    64    65   0.26850 -1.0 2.0
   66    63    64    68  -0.15000  1.0 1.0
   66    63    64    68   0.89550 -1.0 2.0
   66    63    64    68  -0.06900  1.0 3.0
   66    69    40    33   0.07850  1.0 1.0
   66    69    40    33  -0.03950 -1.0 2.0
   66    69    40    33   0.67350  1.0 3.0
   66    69    40    41   0.15000  1.0 3.0
   66    69    40    48   0.86500  1.0 1.0
   66    69    40    48  -0.17500 -1.0 2.0
   66    69    40    48   0.20800  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   67    66    69    40   0.15000  1.0 3.0
   67    66   -69    71   0.23400  1.0 3.0
   67    66   -71    69   0.36800  1.0 3.0
   69    40    48    49  -0.11600  1.0 1.0
   69    40    48    49  -0.09450 -1.0 2.0
   69    40    48    49   0.21250  1.0 3.0
   70    69    40    33   0.15000  1.0 3.0
   70    69    40    41   0.15000  1.0 3.0
   70    69    40    48   0.23400  1.0 3.0
   70    69   -71    66   0.36800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    46   0.56750  1.0 1.0
   40    33    37    46  -0.07550 -1.0 2.0
   40    33    37    46   0.20000  1.0 3.0
   40    33    42    43   0.15000  1.0 3.0
   40    33    42    44   0.15000  1.0 3.0
   40    33    42    45   0.15000  1.0 3.0
   40    69   -71    66   0.06250  1.0 1.0
   40    69   -71    66  -0.01100 -1.0 2.0
   40    69   -71    66   0.28050  1.0 3.0
   41    40    48    49   0.19450  1.0 3.0
   71    66   -69    70   0.23400  1.0 3.0
   71    66   -69    40   0.02550  1.0 1.0
   71    66   -69    40  -0.02600 -1.0 2.0
   71    66   -69    40   1.20400  1.0 3.0
   71    69    40    33   0.02550  1.0 1.0
   71    69    40    33  -0.02600 -1.0 2.0
   71    69    40    33   1.20400  1.0 3.0
   71    69    40    41   0.23400  1.0 3.0
   71    69    40    48   3.69350  1.0 1.0
   71    69    40    48  -1.82950 -1.0 2.0
   42    33    37    38   0.15000  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    46   0.56750  1.0 1.0
   42    33    37    46  -0.07550 -1.0 2.0
   42    33    37    46   0.20000  1.0 3.0
   42    33    40    69   0.47050  1.0 1.0
   42    33    40    69   0.03900 -1.0 2.0
   42    33    40    69   0.20100  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
   42    33    40    48   0.86500  1.0 1.0
   42    33    40    48  -0.17500 -1.0 2.0
   42    33    40    48   0.20800  1.0 3.0
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
   50    55    52    57   1.10000 -1.0 2.0
   52    62    55    56  10.50000 -1.0 2.0
   58    59    57    52   1.10000 -1.0 2.0
   53    61    60    63   1.10000 -1.0 2.0
   64    66    63    60   1.10000 -1.0 2.0
   63    68    64    65  10.50000 -1.0 2.0
END
