* LIGAND DATABASE FILE (OPLS2005)
*
001      75    75    137    209     407
    1     0 S   NP   _N1_     1    28.65935    95.84778   -23.51581
    2     1 S   H    _HN1     2     1.02828    34.45580   168.60561
    3     1 S   H    _H1_     3     1.02785   102.91611   -88.51964
    4     1 S   H    _H2_     4     1.02950    76.82005    17.63467
    5     1 S   CT   _CA1     5     1.50113   138.61879   123.64498
    6     5 S   HC   _HA1     6     1.09573   105.19852    84.53801
    7     5 S   CO3  _C1_     7     1.53795   112.44980   -35.68678
    8     7 S   O2Z  _O11     8     1.26371   115.00619   -42.64219
    9     7 S   O2Z  _O12     9     1.26239   114.95066   136.47716
   10     5 S   CT   _CB1    10     1.53080   107.41536  -157.49081
   11    10 S   HC   HB11    11     1.09830   109.37645   -49.80401
   12    10 S   HC   HB12    12     1.09813   110.44693    66.81052
   13    10 S   CT   _CG1    13     1.52972   112.59383  -170.79436
   14    13 S   HC   HG11    14     1.09595   110.59261   -65.22723
   15    13 S   HC   HG12    15     1.09669   109.82602    53.99632
   16    13 S   C    _CD1    16     1.51798   112.28743   174.43817
   17    16 S   O    _OE1    17     1.22715   123.30721     4.83469
   18    16 S   N    _N2_    18     1.38591   111.55947  -175.12995
   19    18 S   H    _HN2    19     1.01569   118.97688     1.98071
   20    18 S   CT1  _CA2    20     1.46335   123.62301   178.92262
   21    20 S   HC   _HA2    21     1.09743   109.34943     3.99037
   22    20 S   C    _C2_    22     1.53626   108.80328  -111.50544
   23    22 S   O    _O2_    23     1.23060   122.35670  -150.10816
   24    20 S   CT   _CB2    32     1.53682   111.14999   126.03629
   25    24 S   HC   HB21    33     1.09150   108.51271    55.75549
   26    24 S   HC   HB22    34     1.09413   109.48807   174.84695
   27    22 S   N    _N3_    24     1.38362   113.79083    37.50550
   28    27 S   H    _HN3    25     1.01564   119.54972    -3.44122
   29    24 S   S    _SG2    35     1.82492   110.38055   -66.35103
   30    27 S   CT   _CA3    26     1.45272   123.19426   177.08523
   31    30 S   HC   HA31    27     1.09550   107.52278   -64.29898
   32    30 S   HC   HA32    28     1.09558   107.96873    52.13014
   33    29 S   CT   _C10    36     1.92912   106.05959   163.97197
   34    30 S   CO3  _C3_    29     1.52947   114.10674   174.12894
   35    34 S   O2Z  _O31    30     1.26374   116.09252    -0.32746
   36    34 S   O2Z  _O32    31     1.26434   114.40532   179.72094
   37    33 S   CT   _C15    37     1.62623   109.18886   -88.77347
   38    33 S   CM   _C9_    62     1.57570   104.22161   157.51985
   39    38 S   HC   _H9_    63     1.08579   113.51855   155.18604
   40    37 S   CT   _C14    38     1.56016   110.81263  -179.89913
   41    40 S   HC   _H12    39     1.09946   110.11913  -172.44851
   42    40 S   HC   _H13    40     1.09763   110.84135    73.80640
   43    37 S   CT   _C16    54     1.55948   112.33000   -60.86350
   44    43 S   HC   _H14    55     1.09439   112.12711    61.84786
   45    43 S   HC   _H15    56     1.09435   112.51674   -60.15900
   46    43 S   HC   _H16    57     1.09721   110.67189  -179.01682
   47    37 S   CT   _C17    58     1.55118   114.54648    58.50132
   48    47 S   HC   _H17    59     1.09361   111.99009   -65.50291
   49    47 S   HC   _H18    60     1.09768   110.58722   176.76263
   50    47 S   HC   _H19    61     1.09062   113.42899    57.82084
   51    38 S   CM   _C8_    64     1.34862   130.34444   -27.10837
   52    51 S   HC   _H8_    65     1.08512   118.63447    -0.98655
   53    40 S   CT   _C13    41     1.52531   114.63196   -49.89159
   54    53 S   HC   _H3_    42     1.09543   109.79582   -69.90702
   55    51 S   CM   _C5_    66     1.46415   126.20099  -179.81762
   56    53 S   CT   _C12    43     1.53351   112.43495    53.78968
   57    56 S   HC   _H10    44     1.09913   108.63425    67.80008
   58    56 S   HC   _H11    45     1.10162   108.54343   179.97202
   59    53 S   OH   _O35    52     1.42869   108.01883   174.15383
   60    59 S   HO   _H20    53     0.97244   107.18767   179.57989
   61    55 S   CM   _C6_    67     1.34706   123.23657   176.09846
   62    61 S   HC   _H7_    68     1.09067   119.14097   177.18944
   63    55 S   CT   _C4_    72     1.50959   118.11878    -5.32428
   64    63 S   HC   _H4_    73     1.09550   110.72479    63.53234
   65    63 S   HC   _H5_    74     1.09591   112.27385  -177.02402
   66    63 S   HC   _H6_    75     1.09561   110.80233   -57.57269
   67    33 S   CT   _C11    46     1.60590   117.22680    41.00442
   68    67 S   OM   _O36    47     1.32187   113.17982   -59.18886
   69    61 S   CO3  _C7_    69     1.53026   125.61113    -1.70261
   70    69 S   O2Z  _O34    70     1.26457   114.35715   121.03493
   71    69 S   O2Z  _O33    71     1.26305   115.81679   -61.18878
   72    67 S   CT   _C18    48     1.55281   113.32950    60.65859
   73    72 S   HC   _H21    49     1.09682   112.39556   -54.94684
   74    72 S   HC   _H22    50     1.09969   112.00754  -175.25364
   75    72 S   HC   _H23    51     1.09528   111.85075    66.26496
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  27   2   1   1  21  13   4  18   7   6   9   3   2   1   5   2
   1   1  10   3   9   6   9  10   5   4   2   1   8   4   4   2
   1   1   5   4   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    67    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    56    67    68    72    43    47    38    39    51  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    42    53    56    57    58    67    68    72    73    74    75    43    44    45    46    47    48    49    50    38    39    51    52    55  
   35    36  
   36  
    0  
   40    41    42    53    54    56    67    68    72    59    43    44    45    46    47    48    49    50    38    39    51  
   39    51    52    55    61    63    40    43    47    56    67    68    72  
   51    52    55    67  
   41    42    53    54    56    57    58    67    59    60    43    44    45    46    47    48    49    50  
   42    53    54    56    59    43    47  
   53    54    56    59    43    47  
   44    45    46    47    48    49    50    53    67  
   45    46    47  
   46    47  
   47  
   48    49    50    53    67  
   49    50  
   50  
    0  
   52    55    61    62    69    63    64    65    66    67  
   55    61    63  
   54    56    57    58    67    68    72    59    60  
   56    57    58    67    59    60  
   61    62    69    70    71    63    64    65    66  
   57    58    67    68    72    73    74    75    59    60  
   58    67    68    72    59  
   67    68    72    59  
   60    67  
    0  
   62    69    70    71    63    64    65    66  
   69    70    71    63  
   64    65    66    69  
   65    66  
   66  
    0  
   68    72    73    74    75  
   72    73    74    75  
   70    71  
   71  
    0  
   73    74    75  
   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  -0.335000   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   69   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   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   268.000  1.529
   33    67   268.000  1.529
   33    38   317.000  1.510
   37    40   268.000  1.529
   37    43   268.000  1.529
   37    47   268.000  1.529
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    53   268.000  1.529
   53    54   340.000  1.090
   53    56   268.000  1.529
   53    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    67   268.000  1.529
   67    68   570.000  1.307
   67    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   59    60   553.000  0.945
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   38    39   340.000  1.080
   38    51   549.000  1.340
   51    52   340.000  1.080
   51    55   380.000  1.444
   55    61   549.000  1.340
   55    63   317.000  1.510
   61    62   340.000  1.080
   61    69   230.000  1.545
   69    70   656.000  1.250
   69    71   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   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    67    75.00000  111.63000
   29    33    38    75.00000  112.20000
   33    37    40    58.35000  112.70000
   33    37    43    58.35000  112.70000
   33    37    47    58.35000  112.70000
   33    67    56    58.35000  112.70000
   33    67    68    50.00000  109.50000
   33    67    72    58.35000  112.70000
   33    38    39    35.00000  117.00000
   33    38    51    70.00000  124.00000
   37    40    41    37.50000  110.70000
   37    40    42    37.50000  110.70000
   37    40    53    58.35000  112.70000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    46    37.50000  110.70000
   37    47    48    37.50000  110.70000
   37    47    49    37.50000  110.70000
   37    47    50    37.50000  110.70000
   40    53    54    37.50000  110.70000
   40    53    56    58.35000  112.70000
   40    53    59    50.00000  109.50000
   42    40    41    33.00000  107.80000
   53    40    41    37.50000  110.70000
   53    40    42    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    67    58.35000  112.70000
   53    59    60    55.00000  108.50000
   56    53    54    37.50000  110.70000
   56    67    68    50.00000  109.50000
   56    67    72    58.35000  112.70000
   58    56    57    33.00000  107.80000
   67    33    37    58.35000  112.70000
   67    56    57    37.50000  110.70000
   67    56    58    37.50000  110.70000
   67    72    73    37.50000  110.70000
   67    72    74    37.50000  110.70000
   67    72    75    37.50000  110.70000
   72    67    68    50.00000  109.50000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   59    53    54    35.00000  109.50000
   59    53    56    50.00000  109.50000
   43    37    40    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    37    40    58.35000  112.70000
   47    37    43    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    67    70.00000  112.02700
   38    51    52    35.00000  120.00000
   38    51    55    70.00000  123.01800
   51    38    39    35.00000  120.00000
   51    55    61    70.00000  123.01800
   51    55    63    70.00000  124.00000
   55    51    52    35.00000  120.00000
   55    61    62    35.00000  120.00000
   55    61    69    55.00000  124.75400
   55    63    64    35.00000  109.50000
   55    63    65    35.00000  109.50000
   55    63    66    35.00000  109.50000
   61    69    70    85.00000  113.83300
   61    69    71    85.00000  113.83300
   69    61    62    40.00000  118.53000
   71    69    70    80.00000  126.00000
   63    55    61    70.00000  124.00000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    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    67   0.01700  1.0 1.0
   24    29    33    67  -0.23550 -1.0 2.0
   24    29    33    67   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.44750  1.0 1.0
   29    33    37    40  -0.17800 -1.0 2.0
   29    33    37    40   0.20200  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    37    47   0.44750  1.0 1.0
   29    33    37    47  -0.17800 -1.0 2.0
   29    33    37    47   0.20200  1.0 3.0
   29    33    67    56   0.44750  1.0 1.0
   29    33    67    56  -0.17800 -1.0 2.0
   29    33    67    56   0.20200  1.0 3.0
   29    33    67    68   0.56750  1.0 1.0
   29    33    67    68  -0.07550 -1.0 2.0
   29    33    67    68   0.20000  1.0 3.0
   29    33    67    72   0.44750  1.0 1.0
   29    33    67    72  -0.17800 -1.0 2.0
   29    33    67    72   0.20200  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    51   0.42700  1.0 1.0
   29    33    38    51  -0.70350 -1.0 2.0
   29    33    38    51  -0.43150  1.0 3.0
   33    37    40    41   0.15000  1.0 3.0
   33    37    40    42   0.15000  1.0 3.0
   33    37    40    53   0.56750  1.0 1.0
   33    37    40    53  -0.07550 -1.0 2.0
   33    37    40    53   0.20000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    46   0.15000  1.0 3.0
   33    37    47    48   0.15000  1.0 3.0
   33    37    47    49   0.15000  1.0 3.0
   33    37    47    50   0.15000  1.0 3.0
   33    67    72    73   0.15000  1.0 3.0
   33    67    72    74   0.15000  1.0 3.0
   33    67    72    75   0.15000  1.0 3.0
   33    38    51    52   7.00000 -1.0 2.0
   33    38    51    55   7.00000 -1.0 2.0
   37    33    67    56   0.56750  1.0 1.0
   37    33    67    56  -0.07550 -1.0 2.0
   37    33    67    56   0.20000  1.0 3.0
   37    33    67    68   0.62750  1.0 1.0
   37    33    67    68  -0.30950 -1.0 2.0
   37    33    67    68   0.27300  1.0 3.0
   37    33    67    72   0.56750  1.0 1.0
   37    33    67    72  -0.07550 -1.0 2.0
   37    33    67    72   0.20000  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    51   0.09850  1.0 1.0
   37    33    38    51   0.15250 -1.0 2.0
   37    33    38    51  -0.50650  1.0 3.0
   37    40    53    54   0.15000  1.0 3.0
   37    40   -53    56   0.56750  1.0 1.0
   37    40   -53    56  -0.07550 -1.0 2.0
   37    40   -53    56   0.20000  1.0 3.0
   37    40    53    59   0.86500  1.0 1.0
   37    40    53    59  -0.17500 -1.0 2.0
   37    40    53    59   0.20800  1.0 3.0
   40    37    43    44   0.15000  1.0 3.0
   40    37    43    45   0.15000  1.0 3.0
   40    37    43    46   0.15000  1.0 3.0
   40    37    47    48   0.15000  1.0 3.0
   40    37    47    49   0.15000  1.0 3.0
   40    37    47    50   0.15000  1.0 3.0
   40    53    56    57   0.15000  1.0 3.0
   40    53    56    58   0.15000  1.0 3.0
   40    53    56    67   0.56750  1.0 1.0
   40    53    56    67  -0.07550 -1.0 2.0
   40    53    56    67   0.20000  1.0 3.0
   40    53    59    60  -0.11600  1.0 1.0
   40    53    59    60  -0.09450 -1.0 2.0
   40    53    59    60   0.21250  1.0 3.0
   41    40    53    54   0.15000  1.0 3.0
   41    40    53    56   0.15000  1.0 3.0
   41    40    53    59   0.23400  1.0 3.0
   42    40    53    54   0.15000  1.0 3.0
   42    40    53    56   0.15000  1.0 3.0
   42    40    53    59   0.23400  1.0 3.0
   53    56   -67    33   0.56750  1.0 1.0
   53    56   -67    33  -0.07550 -1.0 2.0
   53    56   -67    33   0.20000  1.0 3.0
   53    56    67    68   0.62750  1.0 1.0
   53    56    67    68  -0.30950 -1.0 2.0
   53    56    67    68   0.27300  1.0 3.0
   53    56    67    72   0.56750  1.0 1.0
   53    56    67    72  -0.07550 -1.0 2.0
   53    56    67    72   0.20000  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    67   0.15000  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   56    53    59    60  -0.11600  1.0 1.0
   56    53    59    60  -0.09450 -1.0 2.0
   56    53    59    60   0.21250  1.0 3.0
   56    67    72    73   0.15000  1.0 3.0
   56    67    72    74   0.15000  1.0 3.0
   56    67    72    75   0.15000  1.0 3.0
   57    56    67    33   0.15000  1.0 3.0
   57    56    67    68   0.23400  1.0 3.0
   57    56    67    72   0.15000  1.0 3.0
   58    56    67    33   0.15000  1.0 3.0
   58    56    67    68   0.23400  1.0 3.0
   58    56    67    72   0.15000  1.0 3.0
   67    33   -37    40   0.56750  1.0 1.0
   67    33   -37    40  -0.07550 -1.0 2.0
   67    33   -37    40   0.20000  1.0 3.0
   67    33    37    43   0.56750  1.0 1.0
   67    33    37    43  -0.07550 -1.0 2.0
   67    33    37    43   0.20000  1.0 3.0
   67    33    37    47   0.56750  1.0 1.0
   67    33    37    47  -0.07550 -1.0 2.0
   67    33    37    47   0.20000  1.0 3.0
   67    33    38    39   0.00000  1.0 1.0
   67    33    38    51   0.09850  1.0 1.0
   67    33    38    51   0.15250 -1.0 2.0
   67    33    38    51  -0.50650  1.0 3.0
   68    67    72    73   0.23400  1.0 3.0
   68    67    72    74   0.23400  1.0 3.0
   68    67    72    75   0.23400  1.0 3.0
   59    53    56    57   0.23400  1.0 3.0
   59    53    56    58   0.23400  1.0 3.0
   59    53    56    67   0.86500  1.0 1.0
   59    53    56    67  -0.17500 -1.0 2.0
   59    53    56    67   0.20800  1.0 3.0
   43    37    40    41   0.15000  1.0 3.0
   43    37    40    42   0.15000  1.0 3.0
   43    37    40    53   0.56750  1.0 1.0
   43    37    40    53  -0.07550 -1.0 2.0
   43    37    40    53   0.20000  1.0 3.0
   43    37    47    48   0.15000  1.0 3.0
   43    37    47    49   0.15000  1.0 3.0
   43    37    47    50   0.15000  1.0 3.0
   47    37    40    41   0.15000  1.0 3.0
   47    37    40    42   0.15000  1.0 3.0
   47    37    40    53   0.56750  1.0 1.0
   47    37    40    53  -0.07550 -1.0 2.0
   47    37    40    53   0.20000  1.0 3.0
   47    37    43    44   0.15000  1.0 3.0
   47    37    43    45   0.15000  1.0 3.0
   47    37    43    46   0.15000  1.0 3.0
   38    33    37    40   0.34400  1.0 1.0
   38    33    37    40   0.09450 -1.0 2.0
   38    33    37    40   0.11100  1.0 3.0
   38    33    37    43   0.34400  1.0 1.0
   38    33    37    43   0.09450 -1.0 2.0
   38    33    37    43   0.11100  1.0 3.0
   38    33    37    47   0.34400  1.0 1.0
   38    33    37    47   0.09450 -1.0 2.0
   38    33    37    47   0.11100  1.0 3.0
   38    33    67    56   0.34400  1.0 1.0
   38    33    67    56   0.09450 -1.0 2.0
   38    33    67    56   0.11100  1.0 3.0
   38    33    67    68   0.61850  1.0 1.0
   38    33    67    68  -0.22750 -1.0 2.0
   38    33    67    68   0.15300  1.0 3.0
   38    33    67    72   0.34400  1.0 1.0
   38    33    67    72   0.09450 -1.0 2.0
   38    33    67    72   0.11100  1.0 3.0
   38    51    55    61   0.28850  1.0 1.0
   38    51    55    61   2.61350 -1.0 2.0
   38    51    55    61   0.78400  1.0 3.0
   38    51    55    63  -0.18600  1.0 3.0
   39    38    51    52   7.00000 -1.0 2.0
   39    38    51    55   7.00000 -1.0 2.0
   51    55    61    62   7.00000 -1.0 2.0
   51    55    61    69   7.00000 -1.0 2.0
   51    55    63    64   0.00000  1.0 1.0
   51    55    63    65   0.00000  1.0 1.0
   51    55    63    66   0.00000  1.0 1.0
   52    51    55    61  -0.18600  1.0 3.0
   52    51    55    63   0.00000  1.0 1.0
   55    61    69    70  -0.04000 -1.0 2.0
   55    61    69    70  -0.29050  1.0 3.0
   55    61    69    71  -0.04000 -1.0 2.0
   55    61    69    71  -0.29050  1.0 3.0
   61    55    63    64   0.00000  1.0 1.0
   61    55    63    65   0.00000  1.0 1.0
   61    55    63    66   0.00000  1.0 1.0
   62    61    69    70   0.00000  1.0 1.0
   62    61    69    71   0.00000  1.0 1.0
   63    55    61    62   7.00000 -1.0 2.0
   63    55    61    69   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    39    38    51  15.00000 -1.0 2.0
   55    52    51    38  15.00000 -1.0 2.0
   51    63    55    61  15.00000 -1.0 2.0
   69    62    61    55  15.00000 -1.0 2.0
   70    61    69    71  10.50000 -1.0 2.0
END
