* LIGAND DATABASE FILE (OPLS2005)
*
001      71    71    126    174     355
    1     0 S   NP   _N1_     1    28.02857    96.22458   -22.80422
    2     1 S   H    _HN1     2     1.02957    78.63797    -6.50927
    3     1 S   H    _H1_     3     1.02835    33.66446   140.75932
    4     1 S   H    _H2_     4     1.02776   100.90317  -113.25862
    5     1 S   CT   _CA1     5     1.50139   139.53824   101.65518
    6     5 S   HC   _HA1     6     1.09573   105.21326    81.14703
    7     5 S   CO3  _C1_     7     1.53788   112.35311   -39.05705
    8     7 S   O2Z  _O11     8     1.26370   114.99047   -43.65074
    9     7 S   O2Z  _O12     9     1.26231   114.93643   135.41847
   10     5 S   CT   _CB1    10     1.53092   107.41847  -160.91839
   11    10 S   HC   HB11    11     1.09828   109.35455   -50.17172
   12    10 S   HC   HB12    12     1.09816   110.41627    66.38958
   13    10 S   CT   _CG1    13     1.53022   112.67701  -171.22179
   14    13 S   HC   HG11    14     1.09592   110.51668   -64.32315
   15    13 S   HC   HG12    15     1.09656   109.90697    54.88996
   16    13 S   C    _CD1    16     1.51840   112.28195   175.28507
   17    16 S   O    _OE1    17     1.22755   123.28512     1.38282
   18    16 S   N    _N2_    18     1.38541   111.73588  -178.73638
   19    18 S   H    _HN2    19     1.01577   119.06419     4.41220
   20    18 S   CT1  _CA2    20     1.45858   122.88147   178.06063
   21    20 S   HC   _HA2    21     1.09720   108.94894    24.01320
   22    20 S   C    _C2_    22     1.52887   106.87941   -93.19122
   23    22 S   O    _O2_    23     1.22989   122.97558   -28.95491
   24    20 S   CT   _CB2    32     1.53219   112.14981   147.17582
   25    24 S   HC   HB21    33     1.09463   109.61623    55.10516
   26    24 S   HC   HB22    34     1.09453   109.84552   173.83922
   27    22 S   N    _N3_    24     1.38475   112.62928   153.70339
   28    27 S   H    _HN3    25     1.01652   120.39632    -1.26733
   29    24 S   S    _SG2    35     1.83080   110.73845   -66.01090
   30    27 S   CT   _CA3    26     1.45352   122.42593   178.61662
   31    30 S   HC   HA31    27     1.09565   107.56145   -61.76132
   32    30 S   HC   HA32    28     1.09569   107.84367    54.55532
   33    29 S   CT   _C10    36     1.87449   101.22300   173.47111
   34    30 S   CO3  _C3_    29     1.52883   114.38344   176.56065
   35    34 S   O2Z  _O31    30     1.26329   116.08553     0.88845
   36    34 S   O2Z  _O32    31     1.26451   114.39672  -179.06330
   37    33 S   CM   _C5_    37     1.52875   109.65194    59.37838
   38    33 S   CT   _C11    58     1.55851   106.92287  -178.02722
   39    38 S   HC   _H6_    59     1.09824   110.63525   -59.81533
   40    38 S   HC   _H7_    60     1.09573   110.15229    55.39150
   41    37 S   CMA  _C6_    38     1.36008   123.30940  -118.32103
   42    41 S   OM   _O36    39     1.26405   129.30953  -177.90837
   43    37 S   CT   _C4_    54     1.52371   116.30849    63.52121
   44    43 S   HC   _H3_    55     1.09357   111.34577   -56.38446
   45    43 S   HC   _H4_    56     1.09466   113.20580  -175.83886
   46    43 S   HC   _H5_    57     1.09392   110.73018    64.51316
   47    38 S   CM   _C12    61     1.51202   113.61032   179.64173
   48    47 S   HC   _H8_    62     1.08985   114.10028    69.11874
   49    41 S   CM   _C7_    40     1.48205   118.81789     1.18068
   50    47 S   CM   _C13    63     1.34690   128.33245  -111.59980
   51    49 S   CM   _C8_    41     1.34397   123.89323    -5.55764
   52    49 S   OS   _O35    49     1.39969   117.19942   179.52522
   53    50 S   CT   _C14    64     1.50629   120.22571  -179.78150
   54    53 S   HC   _H9_    65     1.09495   110.23931   120.60843
   55    53 S   HC   _H10    66     1.09504   110.21122  -119.57585
   56    53 S   HC   _H11    67     1.09511   112.46981     0.48658
   57    50 S   CT   _C15    68     1.50253   125.64243     0.63612
   58    57 S   HC   _H12    69     1.09517   110.04241   122.88920
   59    57 S   HC   _H13    70     1.09507   109.99243  -117.96633
   60    57 S   HC   _H14    71     1.09118   113.84107     2.70639
   61    33 S   CO4  _C9_    42     1.53664   105.67168   -64.34416
   62    61 S   O    _O33    43     1.23378   121.95814   -56.62331
   63    51 S   OS   _O34    44     1.38470   121.73754  -177.60714
   64    52 S   CT   _C17    50     1.42907   110.84916   -98.96015
   65    64 S   HC   _H18    51     1.09393   107.80755   175.46253
   66    64 S   HC   _H19    52     1.09537   111.51797    56.89167
   67    64 S   HC   _H20    53     1.09479   111.14375   -66.31609
   68    63 S   CT   _C16    45     1.42614   110.34222   102.66566
   69    68 S   HC   _H15    46     1.09393   107.89654  -176.43201
   70    68 S   HC   _H16    47     1.09442   111.30291    65.19529
   71    68 S   HC   _H17    48     1.09566   111.10984   -58.07725
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  18   2   1   1  15  12   5   4  11   4   5   2   1   1  11   3
  10   8   9   6   7   3   2   1   3   2   1   1   3   1   4   3
   2   1   1   3   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    61    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    51    61    62    43    38    39    40    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    49    51    61    62    63    43    44    45    46    38    39    40    47    48    50  
   35    36  
   36  
    0  
   41    42    49    51    61    62    52    43    44    45    46    38    39    40    47  
   39    40    47    48    50    53    57    41    43    51    61    62  
   40    47    48    50    61  
   47    48    50    61  
   42    49    51    61    63    52    64    43    44    45    46  
   49    51    52    43  
   44    45    46    49    61  
   45    46  
   46  
    0  
   48    50    53    54    55    56    57    58    59    60    61  
   50    53    57  
   51    61    62    63    68    52    64    65    66    67  
   53    54    55    56    57    58    59    60  
   61    62    63    68    69    70    71    52    64  
   64    65    66    67    61    63  
   54    55    56    57    58    59    60  
   55    56    57  
   56    57  
   57  
   58    59    60  
   59    60  
   60  
    0  
   62    63    68  
   63  
   68    69    70    71  
   65    66    67  
   66    67  
   67  
    0  
   69    70    71  
   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   63   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   64   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.030000   1.4250   1.2500   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   222.000  1.810
   33    37   317.000  1.510
   33    61   317.000  1.522
   33    38   268.000  1.529
   37    41   465.000  1.376
   37    43   317.000  1.510
   41    42   745.000  1.250
   41    49   465.000  1.376
   49    51   549.000  1.340
   49    52   440.000  1.360
   51    61   320.000  1.462
   51    63   440.000  1.360
   61    62   570.000  1.229
   63    68   320.000  1.410
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   52    64   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    47   317.000  1.510
   47    48   340.000  1.080
   47    50   549.000  1.340
   50    53   317.000  1.510
   50    57   317.000  1.510
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   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  112.20000
   29    33    61    75.00000  110.18000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    43    65.00000  117.92700
   33    61    51    65.00000  118.62400
   33    61    62    80.00000  120.40000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    47    70.00000  112.02700
   37    41    42    65.00000  137.10300
   37    41    49    70.00000  123.01800
   37    43    44    35.00000  109.50000
   37    43    45    35.00000  109.50000
   37    43    46    35.00000  109.50000
   41    49    51    70.00000  117.34000
   41    49    52    80.00000  120.01400
   49    41    42    65.00000  137.10300
   49    51    61    65.00000  118.96000
   49    51    63    80.00000  120.01400
   49    52    64    90.00000  111.18400
   51    61    62    80.00000  123.72100
   51    63    68    90.00000  111.18400
   61    33    37    70.00000  109.06800
   63    51    61    85.00000  116.28000
   63    68    69    35.00000  109.50000
   63    68    70    35.00000  109.50000
   63    68    71    35.00000  109.50000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   52    49    51    80.00000  120.01400
   52    64    65    35.00000  109.50000
   52    64    66    35.00000  109.50000
   52    64    67    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   43    37    41    70.00000  124.00000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    61    63.00000  111.10000
   38    47    48    35.00000  117.00000
   38    47    50    70.00000  124.00000
   40    38    39    33.00000  107.80000
   47    38    39    35.00000  109.50000
   47    38    40    35.00000  109.50000
   47    50    53    70.00000  124.00000
   47    50    57    70.00000  124.00000
   50    47    48    35.00000  120.00000
   50    53    54    35.00000  109.50000
   50    53    55    35.00000  109.50000
   50    53    56    35.00000  109.50000
   50    57    58    35.00000  109.50000
   50    57    59    35.00000  109.50000
   50    57    60    35.00000  109.50000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   57    50    53    65.00000  117.92700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    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  -0.62250  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    61   0.01700  1.0 1.0
   24    29    33    61  -0.23550 -1.0 2.0
   24    29    33    61   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    43   0.30250  1.0 1.0
   29    33    37    43  -0.14950 -1.0 2.0
   29    33    37    43   0.36900  1.0 3.0
   29    33    61    51   0.65300  1.0 1.0
   29    33    61    51  -0.03850 -1.0 2.0
   29    33    61    51   0.33900  1.0 3.0
   29    33    61    62   0.30150 -1.0 2.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    47   0.56750  1.0 1.0
   29    33    38    47  -0.07550 -1.0 2.0
   29    33    38    47   0.20000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    49   7.00000 -1.0 2.0
   33    37    43    44   0.34800  1.0 3.0
   33    37    43    45   0.34800  1.0 3.0
   33    37    43    46   0.34800  1.0 3.0
   33    38    47    48   0.00000  1.0 1.0
   33    38    47    50   0.09850  1.0 1.0
   33    38    47    50   0.15250 -1.0 2.0
   33    38    47    50  -0.50650  1.0 3.0
   37    33    61    51   0.65300  1.0 1.0
   37    33    61    51  -0.03850 -1.0 2.0
   37    33    61    51   0.33900  1.0 3.0
   37    33    61    62   0.30150 -1.0 2.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    47   0.31000  1.0 1.0
   37    33    38    47   0.14700 -1.0 2.0
   37    33    38    47   0.07550  1.0 3.0
   37    41   -49    51   7.00000 -1.0 2.0
   37    41    49    52   7.00000 -1.0 2.0
   41    37    43    44   0.00000  1.0 1.0
   41    37    43    45   0.00000  1.0 1.0
   41    37    43    46   0.00000  1.0 1.0
   41    49    51    61   7.00000 -1.0 2.0
   41    49    51    63   7.00000 -1.0 2.0
   41    49    52    64  -2.26850  1.0 1.0
   41    49    52    64   3.39050 -1.0 2.0
   42    41    49    51   7.00000 -1.0 2.0
   42    41    49    52   7.00000 -1.0 2.0
   49    51   -61    33  -0.33500  1.0 1.0
   49    51   -61    33   1.06600 -1.0 2.0
   49    51   -61    33  -0.14000  1.0 3.0
   49    51    61    62   1.00000 -1.0 2.0
   49    51    63    68  -2.26850  1.0 1.0
   49    51    63    68   3.39050 -1.0 2.0
   49    52    64    65   0.08050  1.0 3.0
   49    52    64    66   0.08050  1.0 3.0
   49    52    64    67   0.08050  1.0 3.0
   51    49    52    64  -2.26850  1.0 1.0
   51    49    52    64   3.39050 -1.0 2.0
   51    63    68    69   0.08050  1.0 3.0
   51    63    68    70   0.08050  1.0 3.0
   51    63    68    71   0.08050  1.0 3.0
   61    33   -37    41  -0.51250  1.0 1.0
   61    33   -37    41  -0.88800 -1.0 2.0
   61    33   -37    41   0.08850  1.0 3.0
   61    33    37    43   0.17250  1.0 1.0
   61    33    37    43  -0.04100 -1.0 2.0
   61    33    37    43  -0.33850  1.0 3.0
   61    33    38    39  -0.11250  1.0 3.0
   61    33    38    40  -0.11250  1.0 3.0
   61    33    38    47  -0.98800  1.0 1.0
   61    33    38    47   0.48800 -1.0 2.0
   61    33    38    47   0.76800  1.0 3.0
   61    51    63    68   0.15100 -1.0 2.0
   63    51    61    33   0.32450 -1.0 2.0
   63    51    61    33   0.17400  1.0 3.0
   63    51    61    62  -0.11900  1.0 1.0
   63    51    61    62   0.76850 -1.0 2.0
   63    51    61    62   0.14100  1.0 3.0
   52    49    51    61   7.00000 -1.0 2.0
   52    49    51    63   7.00000 -1.0 2.0
   43    37    41    42   7.00000 -1.0 2.0
   43    37    41    49   7.00000 -1.0 2.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    37    43   0.46850  1.0 1.0
   38    33    37    43   0.08550 -1.0 2.0
   38    33    37    43   0.09800  1.0 3.0
   38    33    61    51   0.65300  1.0 1.0
   38    33    61    51  -0.03850 -1.0 2.0
   38    33    61    51   0.33900  1.0 3.0
   38    33    61    62   0.30150 -1.0 2.0
   38    47    50    53   7.00000 -1.0 2.0
   38    47    50    57   7.00000 -1.0 2.0
   39    38    47    48   0.33100  1.0 3.0
   39    38    47    50   0.00000  1.0 1.0
   40    38    47    48   0.33100  1.0 3.0
   40    38    47    50   0.00000  1.0 1.0
   47    50    53    54   0.00000  1.0 1.0
   47    50    53    55   0.00000  1.0 1.0
   47    50    53    56   0.00000  1.0 1.0
   47    50    57    58   0.00000  1.0 1.0
   47    50    57    59   0.00000  1.0 1.0
   47    50    57    60   0.00000  1.0 1.0
   48    47    50    53   7.00000 -1.0 2.0
   48    47    50    57   7.00000 -1.0 2.0
   53    50    57    58   0.34800  1.0 3.0
   53    50    57    59   0.34800  1.0 3.0
   53    50    57    60   0.34800  1.0 3.0
   57    50    53    54   0.34800  1.0 3.0
   57    50    53    55   0.34800  1.0 3.0
   57    50    53    56   0.34800  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
   33    43    37    41   1.10000 -1.0 2.0
   49    42    41    37   1.10000 -1.0 2.0
   41    52    49    51   1.10000 -1.0 2.0
   61    63    51    49   1.10000 -1.0 2.0
   33    51    61    62  10.50000 -1.0 2.0
   38    48    47    50  15.00000 -1.0 2.0
   53    57    50    47  15.00000 -1.0 2.0
END
