* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    129    199     372
    1     0 S   NP   _N1_     1    28.35262    98.20607   -21.24808
    2     1 S   H    _HN1     2     1.02794   105.67616  -128.94413
    3     1 S   H    _H1_     3     1.02870    67.94504   -25.30516
    4     1 S   H    _H2_     4     1.02937    42.42498   131.74694
    5     1 S   CT   _CA1     5     1.50479   139.76263    71.85025
    6     5 S   HC   _HA1     6     1.09698   104.62877   101.11009
    7     5 S   CO3  _C1_     7     1.54212   110.74061   -14.99425
    8     7 S   O2Z  _O11     8     1.25999   116.56787  -108.83386
    9     7 S   O2Z  _O12     9     1.26546   113.81267    69.59694
   10     5 S   CT   _CB1    10     1.53111   107.00485  -143.05320
   11    10 S   HC   HB11    11     1.09847   109.55775   -45.50783
   12    10 S   HC   HB12    12     1.09767   110.50989    71.09791
   13    10 S   CT   _CG1    13     1.53039   112.38398  -166.07324
   14    13 S   HC   HG11    14     1.09494   110.92314   -65.03203
   15    13 S   HC   HG12    15     1.09653   109.62706    54.16115
   16    13 S   C    _CD1    16     1.51853   112.12121   174.43782
   17    16 S   O    _OE1    17     1.22767   123.25619     9.49877
   18    16 S   N    _N2_    18     1.38541   111.83185  -170.65809
   19    18 S   H    _HN2    19     1.01516   119.03447     3.11081
   20    18 S   CT1  _CA2    20     1.45948   122.80671   177.30950
   21    20 S   HC   _HA2    21     1.09714   108.87121    29.32888
   22    20 S   C    _C2_    22     1.52948   106.80853   -87.97162
   23    22 S   O    _O2_    23     1.23002   122.96933   -29.10411
   24    20 S   CT   _CB2    32     1.53265   112.10580   152.85230
   25    24 S   HC   HB21    33     1.09281   109.04522    54.98275
   26    24 S   HC   HB22    34     1.09517   110.23972   173.26944
   27    22 S   N    _N3_    24     1.38477   112.62275   153.65219
   28    27 S   H    _HN3    25     1.01657   120.35267    -1.71052
   29    24 S   S    _SG2    35     1.83103   110.63750   -67.03644
   30    27 S   CT   _CA3    26     1.45354   122.43953   178.69674
   31    30 S   HC   HA31    27     1.09567   107.68224   -58.53885
   32    30 S   HC   HA32    28     1.09567   107.71274    57.76391
   33    29 S   CT   _C10    36     1.89901   102.59093   161.75505
   34    33 S   OM   _O36    37     1.32570   108.60613    53.21691
   35    30 S   CO3  _C3_    29     1.52887   114.39063   179.62991
   36    35 S   O2Z  _O31    30     1.26330   116.08619    -0.24629
   37    35 S   O2Z  _O32    31     1.26448   114.40029   179.75691
   38    33 S   CA   _C11    38     1.54486   110.20290   169.65776
   39    33 S   CT   _C9_    52     1.56968   108.00699   -64.84451
   40    39 S   HC   _H3_    53     1.09958   108.60641    71.45675
   41    38 S   CA   _C12    39     1.41730   120.30339   -41.99128
   42    41 S   HA   _H9_    40     1.08811   120.55373    -0.46098
   43    39 S   C    _C8_    54     1.53776   114.57769   -48.68726
   44    43 S   O    _O33    55     1.22910   122.63112   -39.15488
   45    41 S   CA   _C13    41     1.39885   122.35728  -179.58504
   46    45 S   HA   _H10    42     1.08616   119.82744  -179.53228
   47    43 S   N    _N5_    56     1.38945   111.86900   140.28520
   48    47 S   H    _H8_    57     1.01416   121.43607     1.34756
   49    45 S   CA   _C14    43     1.38751   120.05532     0.92577
   50    49 S   HA   _H11    44     1.08563   120.26940   179.86583
   51    47 S   CRA  _C7_    58     1.37498   121.54936  -177.72867
   52    49 S   CA   _C15    45     1.38947   119.47539     0.78609
   53    52 S   HA   _H12    46     1.08732   118.98749   178.75620
   54    51 S   N5B  _N4_    59     1.31091   129.23427    -1.01414
   55    38 S   CA   _C16    47     1.40801   123.90732   141.16141
   56    54 S   C5B  _C6_    60     1.38069   108.87303   179.31901
   57    56 S   HA   _H7_    61     1.08250   118.98305  -179.81869
   58    55 S   SY   _S2_    48     1.76328   122.76562     1.25757
   59    58 S   OY   _O34    49     1.45123   106.97793   120.93522
   60    58 S   OY   _O35    50     1.44958   107.10410  -108.72396
   61    56 S   C5A  _C5_    62     1.38083   115.87104    -0.22294
   62    58 S   NS   _N6_    51     1.69748   103.29563     6.99053
   63    51 S   SA   _S1_    63     1.70755   114.14247   178.22866
   64    61 S   CT   _C4_    64     1.48439   129.56763  -179.42631
   65    64 S   HC   _H4_    65     1.09486   110.54518   110.02385
   66    64 S   HC   _H5_    66     1.09489   111.09891  -129.36323
   67    64 S   HC   _H6_    67     1.09488   110.90594    -9.66375
   68    62 S   CT   _C17    68     1.48008   116.74213   176.55105
   69    68 S   HC   _H13    69     1.09399   110.18389   -48.60499
   70    68 S   HC   _H14    70     1.09416   110.38214  -166.71060
   71    68 S   HC   _H15    71     1.09320   110.80441    72.29669
  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
  15   7   2   1   1  15  16   6   8   4   9   4   6   3   7   3
   5   3   6   6   2   5   5   7   3   7   3   2   5   4   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    55    62    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    55    58    62    39    40    43    44    47    68  
   38    41    55    62    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    49    52    53    55    58    59    60    62    39    40    43  
   40    43    44    47    48    51    68    69    70    71    41    55    58    59    60    62  
   43    44    47    68    58    62  
   42    45    46    49    50    52    55    58  
   45    46    49    55  
   44    47    48    51    54    63    68    58    62  
   47    48    51    62  
   46    49    50    52    53    55  
   49    50    52  
   48    51    54    56    61    63    62  
   51    54    63  
   50    52    53    55    58  
   52    53    55  
   54    56    57    61    63    64  
   53    55    58    59    60    62  
   55    58  
   56    57    61    63    64  
   58    59    60    62    68  
   57    61    63    64    65    66    67  
   61    63    64  
   59    60    62    68    69    70    71  
   60    62    68  
   62    68  
   63    64    65    66    67  
   68    69    70    71  
   64    65    66    67  
   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  -0.175000   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   4.2000   0.3000   0.102500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.168800   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   48   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700   0.385900   2.0020   1.7750   0.001000000  -0.843144165
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.2800   0.1700  -0.480300   1.8650   1.6500   0.001000000  -0.511443539
   55   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.186200   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.098100   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   59   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   60   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5500   0.0700  -0.220900   2.0020   1.7750   0.001000000  -0.843144165
   62   3.2500   0.1700  -0.537600   1.8100   1.6000   0.054801302  -1.445846770
   63   3.5600   0.3950   0.001000   2.0080   1.7800   0.025682759  -1.666211680
   64   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.022200   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.073300   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    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   570.000  1.307
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    55   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   367.000  1.080
   49    52   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    58   225.000  1.779
   58    59   735.000  1.471
   58    60   735.000  1.471
   58    62   245.000  1.722
   62    39   300.000  1.458
   62    68   300.000  1.458
   39    40   340.000  1.090
   39    43   317.000  1.522
   43    44   570.000  1.229
   43    47   490.000  1.335
   47    48   434.000  1.010
   47    51   360.000  1.404
   51    54   488.000  1.335
   51    63   250.000  1.765
   54    56   410.000  1.394
   56    57   367.000  1.080
   56    61   520.000  1.370
   61    63   265.000  1.745
   61    64   295.000  1.489
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   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    85.00000  114.68000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    55    70.00000  120.00000
   33    39    62    80.00000  110.21000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   38    33    34    85.00000  111.85700
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    55    52    63.00000  120.00000
   38    55    58    65.00000  117.06700
   41    45    46    35.00000  120.00000
   41    45    49    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    52    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    52    53    35.00000  120.00000
   49    52    55    63.00000  120.00000
   52    49    50    35.00000  120.00000
   52    55    58    65.00000  117.06700
   55    38    41    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    58    59   100.00000  107.67100
   55    58    60   100.00000  107.67100
   55    58    62    95.00000  101.59200
   58    62    39    75.00000  117.08200
   58    62    68    75.00000  117.08200
   60    58    59   115.00000  120.17200
   62    58    59   115.00000  107.22500
   62    58    60   115.00000  107.22500
   62    39    40    50.00000  109.35000
   62    39    43    75.00000  113.79000
   62    68    69    50.00000  109.35000
   62    68    70    50.00000  109.35000
   62    68    71    50.00000  109.35000
   39    33    34    50.00000  109.50000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    47    70.00000  116.60000
   43    39    40    35.00000  109.50000
   43    47    48    35.00000  119.80000
   43    47    51    65.00000  121.96500
   47    43    44    80.00000  122.90000
   47    51    54    70.00000  120.00000
   47    51    63    70.00000  123.00000
   51    47    48    45.00000  118.23600
   51    54    56    70.00000  110.00000
   51    63    61   120.00000   89.04400
   54    56    57    35.00000  120.00000
   54    56    61    70.00000  111.00000
   56    61    63    80.00000  111.29200
   56    61    64    55.00000  130.44200
   61    56    57    35.00000  128.20000
   61    64    65    45.00000  110.47400
   61    64    66    45.00000  110.47400
   61    64    67    45.00000  110.47400
   63    51    54    80.00000  114.57700
   64    61    63    65.00000  123.52500
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    62    39    75.00000  112.87000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    55  -0.16000  1.0 1.0
   29    33    38    55  -0.03200 -1.0 2.0
   29    33    38    55   0.04500  1.0 3.0
   29    33    39    62   0.56750  1.0 1.0
   29    33    39    62  -0.07550 -1.0 2.0
   29    33    39    62   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    55    52   3.62500 -1.0 2.0
   33    38    55    58   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    47   1.39750  1.0 1.0
   33    39    43    47  -0.07950 -1.0 2.0
   33    39    43    47  -0.18750  1.0 3.0
   34    33    38    41   0.64500  1.0 1.0
   34    33    38    41   0.14800 -1.0 2.0
   34    33    38    41   0.20650  1.0 3.0
   34    33    38    55   0.64500  1.0 1.0
   34    33    38    55   0.14800 -1.0 2.0
   34    33    38    55   0.20650  1.0 3.0
   34    33    39    62   1.74050  1.0 1.0
   34    33    39    40   0.23400  1.0 3.0
   34    33    39    43  -0.09450  1.0 1.0
   34    33    39    43  -1.12950 -1.0 2.0
   34    33    39    43   0.54000  1.0 3.0
   38    33    39    62   0.83750  1.0 1.0
   38    33    39    62   0.32200 -1.0 2.0
   38    33    39    62   0.70600  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    49   3.62500 -1.0 2.0
   38    55    58    59   0.19500  1.0 1.0
   38    55    58    59   0.12000 -1.0 2.0
   38    55    58    60   0.19500  1.0 1.0
   38    55    58    60   0.12000 -1.0 2.0
   38    55   -58    62  -0.49050  1.0 1.0
   38    55   -58    62   0.22250 -1.0 2.0
   38    55   -58    62  -0.39350  1.0 3.0
   41    38    55    52   3.62500 -1.0 2.0
   41    38    55    58   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   41    45   -49    52   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   45    49    52    53   3.62500 -1.0 2.0
   45    49    52    55   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    52   3.62500 -1.0 2.0
   49    52   -55    38   3.62500 -1.0 2.0
   49    52    55    58   3.62500 -1.0 2.0
   50    49    52    53   3.62500 -1.0 2.0
   50    49    52    55   3.62500 -1.0 2.0
   52    55    58    59   0.19500  1.0 1.0
   52    55    58    59   0.12000 -1.0 2.0
   52    55    58    60   0.19500  1.0 1.0
   52    55    58    60   0.12000 -1.0 2.0
   52    55    58    62  -0.49050  1.0 1.0
   52    55    58    62   0.22250 -1.0 2.0
   52    55    58    62  -0.39350  1.0 3.0
   53    52    55    38   3.62500 -1.0 2.0
   53    52    55    58   3.62500 -1.0 2.0
   55    38    41    42   3.62500 -1.0 2.0
   55    38   -41    45   3.62500 -1.0 2.0
   55    58    62    39  -0.64500  1.0 1.0
   55    58    62    39  -1.19050 -1.0 2.0
   55    58    62    39  -0.04400  1.0 3.0
   55    58    62    68  -0.64500  1.0 1.0
   55    58    62    68  -1.19050 -1.0 2.0
   55    58    62    68  -0.04400  1.0 3.0
   58    62   -39    33  -0.71500  1.0 1.0
   58    62   -39    33  -0.42400 -1.0 2.0
   58    62   -39    33   0.18500  1.0 3.0
   58    62    39    40   0.15000  1.0 3.0
   58    62    39    43   0.23200  1.0 1.0
   58    62    39    43   0.02100 -1.0 2.0
   58    62    39    43   0.24950  1.0 3.0
   58    62    68    69   0.15000  1.0 3.0
   58    62    68    70   0.15000  1.0 3.0
   58    62    68    71   0.15000  1.0 3.0
   59    58    62    39  -0.30400  1.0 1.0
   59    58    62    39   0.50450 -1.0 2.0
   59    58    62    39   0.65550  1.0 3.0
   59    58    62    68  -0.30400  1.0 1.0
   59    58    62    68   0.50450 -1.0 2.0
   59    58    62    68   0.65550  1.0 3.0
   60    58    62    39  -0.30400  1.0 1.0
   60    58    62    39   0.50450 -1.0 2.0
   60    58    62    39   0.65550  1.0 3.0
   60    58    62    68  -0.30400  1.0 1.0
   60    58    62    68   0.50450 -1.0 2.0
   60    58    62    68   0.65550  1.0 3.0
   62    39    43    44   0.30150 -1.0 2.0
   62    39    43    47   0.00000  1.0 1.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33   -38    55   0.04150 -1.0 2.0
   39    62    68    69   0.15000  1.0 3.0
   39    62    68    70   0.15000  1.0 3.0
   39    62    68    71   0.15000  1.0 3.0
   39    43    47    48   2.45000 -1.0 2.0
   39    43    47    51   0.76000  1.0 1.0
   39    43    47    51   4.11600 -1.0 2.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    47   0.00000  1.0 1.0
   43    47    51    54   0.96250 -1.0 2.0
   43    47    51    63   0.96250 -1.0 2.0
   44    43    47    48   2.45000 -1.0 2.0
   44    43    47    51   0.04000 -1.0 2.0
   47    51    54    56   3.62500 -1.0 2.0
   47    51    63    61   3.62500 -1.0 2.0
   48    47    51    54   0.96250 -1.0 2.0
   48    47    51    63   0.96250 -1.0 2.0
   51    54    56    57   2.40000 -1.0 2.0
   51    54   -56    61   2.40000 -1.0 2.0
   54    51   -63    61   3.62500 -1.0 2.0
   54    56   -61    63   3.62500 -1.0 2.0
   54    56    61    64   3.62500 -1.0 2.0
   56    61   -63    51   3.62500 -1.0 2.0
   56    61    64    65   0.00000  1.0 1.0
   56    61    64    66   0.00000  1.0 1.0
   56    61    64    67   0.00000  1.0 1.0
   57    56    61    63   3.62500 -1.0 2.0
   57    56    61    64   3.62500 -1.0 2.0
   63    51   -54    56   3.62500 -1.0 2.0
   63    61    64    65   0.00000  1.0 1.0
   63    61    64    66   0.00000  1.0 1.0
   63    61    64    67   0.00000  1.0 1.0
   64    61    63    51   3.62500 -1.0 2.0
   68    62    39    33   0.58650  1.0 1.0
   68    62    39    33   0.12600 -1.0 2.0
   68    62    39    33   0.33350  1.0 3.0
   68    62    39    40   0.15000  1.0 3.0
   68    62    39    43  -1.76800  1.0 1.0
   68    62    39    43   1.02600 -1.0 2.0
   68    62    39    43   0.19700  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
   41    55    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   52    50    49    45   1.10000 -1.0 2.0
   55    53    52    49   1.10000 -1.0 2.0
   52    58    55    38   4.00000 -1.0 2.0
   68    58    62    39   1.00000 -1.0 2.0
   39    47    43    44  10.50000 -1.0 2.0
   48    43    47    51   1.00000 -1.0 2.0
   54    63    51    47   4.00000 -1.0 2.0
   61    57    56    54   1.10000 -1.0 2.0
   64    63    61    56   4.00000 -1.0 2.0
END
