* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    133    200     390
    1     0 S   NP   _N1_     1    28.27387    98.02373   -21.80670
    2     1 S   H    _HN1     2     1.02777    97.40233   -98.98192
    3     1 S   H    _H1_     3     1.02959    65.07299     7.84007
    4     1 S   H    _H2_     4     1.02837    49.20285   153.73904
    5     1 S   CT   _CA1     5     1.50124   149.25109    96.13904
    6     5 S   HC   _HA1     6     1.09574   105.22794   102.30511
    7     5 S   CO3  _C1_     7     1.53791   112.36141   -17.90343
    8     7 S   O2Z  _O11     8     1.26364   114.99623   -44.07062
    9     7 S   O2Z  _O12     9     1.26236   114.93456   135.06168
   10     5 S   CT   _CB1    10     1.53102   107.43096  -139.77629
   11    10 S   HC   HB11    11     1.09825   109.35200   -50.60311
   12    10 S   HC   HB12    12     1.09817   110.41926    65.95926
   13    10 S   CT   _CG1    13     1.53011   112.65422  -171.68133
   14    13 S   HC   HG11    14     1.09597   110.47167   -63.86720
   15    13 S   HC   HG12    15     1.09655   109.93746    55.32510
   16    13 S   C    _CD1    16     1.51836   112.34566   175.70500
   17    16 S   O    _OE1    17     1.22742   123.30092    -0.78634
   18    16 S   N    _N2_    18     1.38562   111.67186   179.17197
   19    18 S   H    _HN2    19     1.01560   118.95426     4.98531
   20    18 S   CT1  _CA2    20     1.45864   122.95456   178.04425
   21    20 S   HC   _HA2    21     1.09717   108.99340    21.70052
   22    20 S   C    _C2_    22     1.52859   106.79380   -95.41589
   23    22 S   O    _O2_    23     1.22990   122.90456   -29.11133
   24    20 S   CT   _CB2    32     1.53132   112.08479   144.78379
   25    24 S   HC   HB21    33     1.09591   110.23631    54.38018
   26    24 S   HC   HB22    34     1.09438   110.03769   173.49633
   27    22 S   N    _N3_    24     1.38466   112.68398   153.50869
   28    27 S   H    _HN3    25     1.01656   120.33963    -2.58346
   29    24 S   S    _SG2    35     1.82768   110.91220   -66.53323
   30    27 S   CT   _CA3    26     1.45379   122.44960  -179.67918
   31    30 S   HC   HA31    27     1.09553   108.08106   -49.13491
   32    30 S   HC   HA32    28     1.09549   107.46835    67.10422
   33    29 S   CT   _C8_    36     1.84693    99.85504   167.92738
   34    33 S   HC   _H3_    37     1.09743   105.10459   -53.58013
   35    30 S   CO3  _C3_    29     1.52842   114.14260  -171.95236
   36    35 S   O2Z  _O31    30     1.26331   115.94632   -17.07732
   37    35 S   O2Z  _O32    31     1.26419   114.51962   162.92690
   38    33 S   C    _C9_    38     1.53394   108.15436    62.61511
   39    38 S   O    _O33    39     1.22902   122.82804    47.04080
   40    33 S   CT   _C5_    62     1.56698   114.15896  -171.15693
   41    38 S   N    _N4_    40     1.39029   112.49035  -133.07177
   42    41 S   H    _H13    41     1.01502   118.43880    -0.14537
   43    40 S   CT   _C4_    63     1.54540   109.91013   178.04626
   44    43 S   HC   _H4_    64     1.09497   111.77449    66.39664
   45    43 S   HC   _H5_    65     1.09634   111.17451  -174.23547
   46    43 S   HC   _H6_    66     1.09574   111.14683   -54.50097
   47    40 S   CT   _C6_    67     1.54637   110.26493    60.27775
   48    47 S   HC   _H7_    68     1.09471   112.12462   -66.78482
   49    47 S   HC   _H8_    69     1.09644   111.09422   173.75553
   50    47 S   HC   _H9_    70     1.09585   111.08251    54.18034
   51    40 S   CT   _C7_    71     1.54181   113.13747   -61.07980
   52    51 S   HC   _H10    72     1.09442   112.09547    60.33613
   53    51 S   HC   _H11    73     1.09456   111.73894   -61.11953
   54    51 S   HC   _H12    74     1.09664   110.77304   179.74821
   55    41 S   CT   _C10    42     1.47972   124.74299   179.48833
   56    55 S   CA   _C13    43     1.53566   110.04104   -64.41065
   57    55 S   CT   _C11    54     1.54746   108.11765   177.42314
   58    57 S   HC   _H14    55     1.09682   111.00323   -61.59446
   59    57 S   HC   _H15    56     1.09620   112.17651    57.48220
   60    57 S   HC   _H16    57     1.09643   111.35621   178.14185
   61    55 S   CT   _C12    58     1.54520   108.93683    62.25609
   62    61 S   HC   _H17    59     1.09687   110.85239    53.62932
   63    61 S   HC   _H18    60     1.09499   112.47043   -65.85007
   64    61 S   HC   _H19    61     1.09638   111.54080   173.24878
   65    56 S   CA   _C14    44     1.40988   119.70656   -53.55015
   66    65 S   HA   _H20    45     1.08772   120.42370     0.29007
   67    65 S   CA   _C15    46     1.39633   121.37369   179.95154
   68    67 S   HA   _H21    47     1.08596   119.95960   179.95154
   69    67 S   CA   _C16    48     1.39025   120.02063    -0.19881
   70    69 S   HA   _H22    49     1.08620   120.14716  -179.69481
   71    69 S   CA   _C17    50     1.39131   119.69506     0.10468
   72    71 S   HA   _H23    51     1.08647   119.84666  -179.82754
   73    56 S   CA   _C18    52     1.40430   122.77971   126.28431
   74    73 S   HA   _H24    53     1.08592   121.42066     0.00000
  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   9   5   4   3
  19   7   2   1   1  11   4  13  13   4  11   4   3   2   7   3
   2   1   3   2   1   1  15  17   9   3   2   1   5   2   1   1
   8   4   6   3   5   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    40    43    47    51  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    55    40    43    44    45    46    47    48    49    50    51    52    53    54  
   38    39    41    40    43    47    51  
   36    37  
   37  
    0  
   39    41    42    55    56    57    61    40    43    47    51  
   41    42    55    40  
   43    44    45    46    47    48    49    50    51    52    53    54    41  
   42    55    56    65    73    57    58    59    60    61    62    63    64  
   55    56    57    61  
   44    45    46    47    48    49    50    51    52    53    54  
   45    46    47    51  
   46    47    51  
   47    51  
   48    49    50    51    52    53    54  
   49    50    51  
   50    51  
   51  
   52    53    54  
   53    54  
   54  
    0  
   56    65    66    67    71    73    74    57    58    59    60    61    62    63    64  
   65    66    67    68    69    71    72    73    74    57    58    59    60    61    62    63    64  
   58    59    60    61    62    63    64    65    73  
   59    60    61  
   60    61  
   61  
   62    63    64    65    73  
   63    64  
   64  
    0  
   66    67    68    69    70    71    73    74  
   67    68    69    73  
   68    69    70    71    72    73  
   69    70    71  
   70    71    72    73    74  
   71    72    73  
   72    73    74  
   73    74  
   74  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   42   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.315000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   73   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   74   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   317.000  1.522
   33    40   268.000  1.529
   38    39   570.000  1.229
   38    41   490.000  1.335
   41    42   434.000  1.010
   41    55   337.000  1.449
   55    56   317.000  1.510
   55    57   268.000  1.529
   55    61   268.000  1.529
   56    65   469.000  1.400
   56    73   469.000  1.400
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    68   367.000  1.080
   67    69   469.000  1.400
   69    70   367.000  1.080
   69    71   469.000  1.400
   71    72   367.000  1.080
   71    73   469.000  1.400
   73    74   367.000  1.080
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   40    43   268.000  1.529
   40    47   268.000  1.529
   40    51   268.000  1.529
   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
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    70.00000  112.33000
   29    33    40    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    41    70.00000  116.60000
   33    40    43    58.35000  112.70000
   33    40    47    58.35000  112.70000
   33    40    51    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  119.80000
   38    41    55    50.00000  121.90000
   41    38    39    80.00000  122.90000
   41    55    56    75.00000  111.96400
   41    55    57    70.00000  110.72300
   41    55    61    70.00000  110.72300
   55    41    42    38.00000  118.40000
   55    56    65    70.00000  120.00000
   55    56    73    70.00000  120.00000
   55    57    58    37.50000  110.70000
   55    57    59    37.50000  110.70000
   55    57    60    37.50000  110.70000
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    64    37.50000  110.70000
   56    65    66    35.00000  120.00000
   56    65    67    63.00000  120.00000
   56    73    71    63.00000  120.00000
   56    73    74    35.00000  120.00000
   65    67    68    35.00000  120.00000
   65    67    69    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    69    70    35.00000  120.00000
   67    69    71    63.00000  120.00000
   69    67    68    35.00000  120.00000
   69    71    72    35.00000  120.00000
   69    71    73    63.00000  120.00000
   71    69    70    35.00000  120.00000
   71    73    74    35.00000  120.00000
   73    56    65    63.00000  120.00000
   73    71    72    35.00000  120.00000
   57    55    56    70.00000  112.17500
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    55    56    70.00000  112.17500
   61    55    57    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    63.00000  111.10000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   40    47    48    37.50000  110.70000
   40    47    49    37.50000  110.70000
   40    47    50    37.50000  110.70000
   40    51    52    37.50000  110.70000
   40    51    53    37.50000  110.70000
   40    51    54    37.50000  110.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    40    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
   51    40    43    58.35000  112.70000
   51    40    47    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.32350  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
   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    41   0.00000  1.0 1.0
   29    33    40    43   0.44750  1.0 1.0
   29    33    40    43  -0.17800 -1.0 2.0
   29    33    40    43   0.20200  1.0 3.0
   29    33    40    47   0.44750  1.0 1.0
   29    33    40    47  -0.17800 -1.0 2.0
   29    33    40    47   0.20200  1.0 3.0
   29    33    40    51   0.44750  1.0 1.0
   29    33    40    51  -0.17800 -1.0 2.0
   29    33    40    51   0.20200  1.0 3.0
   33    38    41    42   2.45000 -1.0 2.0
   33    38    41    55   1.49850  1.0 1.0
   33    38    41    55   1.53950 -1.0 2.0
   33    40    43    44   0.15000  1.0 3.0
   33    40    43    45   0.15000  1.0 3.0
   33    40    43    46   0.15000  1.0 3.0
   33    40    47    48   0.15000  1.0 3.0
   33    40    47    49   0.15000  1.0 3.0
   33    40    47    50   0.15000  1.0 3.0
   33    40    51    52   0.15000  1.0 3.0
   33    40    51    53   0.15000  1.0 3.0
   33    40    51    54   0.15000  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    40    43   0.15000  1.0 3.0
   34    33    40    47   0.15000  1.0 3.0
   34    33    40    51   0.15000  1.0 3.0
   38    33    40    43  -0.95700  1.0 1.0
   38    33    40    43  -0.18200 -1.0 2.0
   38    33    40    43   0.29450  1.0 3.0
   38    33    40    47  -0.95700  1.0 1.0
   38    33    40    47  -0.18200 -1.0 2.0
   38    33    40    47   0.29450  1.0 3.0
   38    33    40    51  -0.95700  1.0 1.0
   38    33    40    51  -0.18200 -1.0 2.0
   38    33    40    51   0.29450  1.0 3.0
   38    41    55    56  -0.69800  1.0 1.0
   38    41    55    56  -0.21350 -1.0 2.0
   38    41    55    57  -0.43950  1.0 1.0
   38    41    55    57  -0.08100 -1.0 2.0
   38    41    55    57   0.03350  1.0 3.0
   38    41    55    61  -0.43950  1.0 1.0
   38    41    55    61  -0.08100 -1.0 2.0
   38    41    55    61   0.03350  1.0 3.0
   39    38    41    42   2.45000 -1.0 2.0
   39    38    41    55   3.04450 -1.0 2.0
   41    55    56    65  -0.24500  1.0 1.0
   41    55    56    65   0.48300 -1.0 2.0
   41    55    56    65   0.08900  1.0 3.0
   41    55    56    73  -0.24500  1.0 1.0
   41    55    56    73   0.48300 -1.0 2.0
   41    55    56    73   0.08900  1.0 3.0
   41    55    57    58   0.15000  1.0 3.0
   41    55    57    59   0.15000  1.0 3.0
   41    55    57    60   0.15000  1.0 3.0
   41    55    61    62   0.15000  1.0 3.0
   41    55    61    63   0.15000  1.0 3.0
   41    55    61    64   0.15000  1.0 3.0
   42    41    55    56   0.00000  1.0 1.0
   42    41    55    57   0.00000  1.0 1.0
   42    41    55    61   0.00000  1.0 1.0
   55    56    65    66   3.62500 -1.0 2.0
   55    56    65    67   3.62500 -1.0 2.0
   55    56    73    71   3.62500 -1.0 2.0
   55    56    73    74   3.62500 -1.0 2.0
   56    55    57    58   0.43200  1.0 3.0
   56    55    57    59   0.43200  1.0 3.0
   56    55    57    60   0.43200  1.0 3.0
   56    55    61    62   0.43200  1.0 3.0
   56    55    61    63   0.43200  1.0 3.0
   56    55    61    64   0.43200  1.0 3.0
   56    65    67    68   3.62500 -1.0 2.0
   56    65    67    69   3.62500 -1.0 2.0
   65    56    73    71   3.62500 -1.0 2.0
   65    56    73    74   3.62500 -1.0 2.0
   65    67    69    70   3.62500 -1.0 2.0
   65    67   -69    71   3.62500 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   66    65    67    69   3.62500 -1.0 2.0
   67    69    71    72   3.62500 -1.0 2.0
   67    69    71    73   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   68    67    69    71   3.62500 -1.0 2.0
   69    71   -73    56   3.62500 -1.0 2.0
   69    71    73    74   3.62500 -1.0 2.0
   70    69    71    72   3.62500 -1.0 2.0
   70    69    71    73   3.62500 -1.0 2.0
   72    71    73    56   3.62500 -1.0 2.0
   72    71    73    74   3.62500 -1.0 2.0
   73    56    65    66   3.62500 -1.0 2.0
   73    56   -65    67   3.62500 -1.0 2.0
   57    55    56    65   0.04150 -1.0 2.0
   57    55    56    73   0.04150 -1.0 2.0
   57    55    61    62   0.15000  1.0 3.0
   57    55    61    63   0.15000  1.0 3.0
   57    55    61    64   0.15000  1.0 3.0
   61    55    56    65   0.04150 -1.0 2.0
   61    55    56    73   0.04150 -1.0 2.0
   61    55    57    58   0.15000  1.0 3.0
   61    55    57    59   0.15000  1.0 3.0
   61    55    57    60   0.15000  1.0 3.0
   40    33    38    39   0.30150 -1.0 2.0
   40    33    38    41   1.39750  1.0 1.0
   40    33    38    41  -0.07950 -1.0 2.0
   40    33    38    41  -0.18750  1.0 3.0
   43    40    47    48   0.15000  1.0 3.0
   43    40    47    49   0.15000  1.0 3.0
   43    40    47    50   0.15000  1.0 3.0
   43    40    51    52   0.15000  1.0 3.0
   43    40    51    53   0.15000  1.0 3.0
   43    40    51    54   0.15000  1.0 3.0
   47    40    43    44   0.15000  1.0 3.0
   47    40    43    45   0.15000  1.0 3.0
   47    40    43    46   0.15000  1.0 3.0
   47    40    51    52   0.15000  1.0 3.0
   47    40    51    53   0.15000  1.0 3.0
   47    40    51    54   0.15000  1.0 3.0
   51    40    43    44   0.15000  1.0 3.0
   51    40    43    45   0.15000  1.0 3.0
   51    40    43    46   0.15000  1.0 3.0
   51    40    47    48   0.15000  1.0 3.0
   51    40    47    49   0.15000  1.0 3.0
   51    40    47    50   0.15000  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
   36    30    35    37  10.50000 -1.0 2.0
   33    41    38    39  10.50000 -1.0 2.0
   42    38    41    55   1.00000 -1.0 2.0
   65    73    56    55   4.00000 -1.0 2.0
   67    66    65    56   1.10000 -1.0 2.0
   69    68    67    65   1.10000 -1.0 2.0
   71    70    69    67   1.10000 -1.0 2.0
   73    72    71    69   1.10000 -1.0 2.0
   71    74    73    56   1.10000 -1.0 2.0
END
