* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    131    209     384
    1     0 S   NP   _N1_     1    28.73382    93.95879   -20.49809
    2     1 S   H    _HN1     2     1.02776    84.23071   -82.42289
    3     1 S   H    _H1_     3     1.02960    97.44578    25.36433
    4     1 S   H    _H2_     4     1.02835    30.56253   136.44761
    5     1 S   CT   _CA1     5     1.50121   139.69270   159.59905
    6     5 S   HC   _HA1     6     1.09565   105.27530    46.86834
    7     5 S   CO3  _C1_     7     1.53853   112.32447   -73.48145
    8     7 S   O2Z  _O11     8     1.26372   115.02286   -43.43755
    9     7 S   O2Z  _O12     9     1.26237   114.93893   135.75569
   10     5 S   CT   _CB1    10     1.53086   107.42931   164.92167
   11    10 S   HC   HB11    11     1.09821   109.55092   -49.17050
   12    10 S   HC   HB12    12     1.09838   110.27726    67.41191
   13    10 S   CT   _CG1    13     1.53044   112.69188  -170.25559
   14    13 S   HC   HG11    14     1.09590   110.34158   -59.42997
   15    13 S   HC   HG12    15     1.09616   110.19098    59.85732
   16    13 S   C    _CD1    16     1.51787   112.08013  -179.72948
   17    16 S   O    _OE1    17     1.22741   123.17873    -9.49076
   18    16 S   N    _N2_    18     1.38657   111.74314   170.44107
   19    18 S   H    _HN2    19     1.01584   119.09419     2.96465
   20    18 S   CT1  _CA2    20     1.46274   123.20610  -174.88626
   21    20 S   HC   _HA2    21     1.09731   109.33542   -14.40592
   22    20 S   C    _C2_    22     1.53316   108.59349  -130.39919
   23    22 S   O    _O2_    23     1.23016   122.19807  -145.84231
   24    20 S   CT   _CB2    32     1.53682   111.24840   107.37680
   25    24 S   HC   HB21    33     1.09424   109.17900    58.19066
   26    24 S   HC   HB22    34     1.09467   110.20046   176.92540
   27    22 S   N    _N3_    24     1.38487   113.34764    41.50649
   28    27 S   H    _HN3    25     1.01533   118.91060    -0.52638
   29    24 S   S    _SG2    35     1.82952   111.20921   -62.91282
   30    27 S   CT   _CA3    26     1.45447   123.40405   175.07371
   31    30 S   HC   HA31    27     1.09526   109.18387    25.32246
   32    30 S   HC   HA32    28     1.09494   107.13373   142.32327
   33    29 S   CT   _C11    36     1.86517   101.58618   171.47601
   34    30 S   CO3  _C3_    29     1.52932   113.16049   -98.11383
   35    34 S   O2Z  _O31    30     1.26398   115.42571   -43.87630
   36    34 S   O2Z  _O32    31     1.26358   114.96743   137.06559
   37    33 S   CA   _C8_    37     1.54446   109.32385    67.08678
   38    33 S   CT   _C12    54     1.53260   108.79563   -60.02066
   39    38 S   HC   _H11    55     1.09666   113.30380   -37.36658
   40    38 S   HC   _H12    56     1.09312   114.81356    85.73143
   41    37 S   CA   _C7_    38     1.40541   123.15885  -123.99507
   42    41 S   HA   _H8_    39     1.08553   121.74932    -0.55673
   43    38 S   OS   _O35    57     1.43257   105.73590  -153.95320
   44    41 S   CA   _C6_    40     1.39877   121.30961  -179.95154
   45    44 S   HA   _H7_    41     1.08668   119.04658  -179.89347
   46    43 S   CO4  _C13    58     1.36520   109.61921    25.17611
   47    46 S   O    _O36    59     1.22197   124.10537   174.36177
   48    44 S   CA   _C5_    42     1.39174   119.71001     0.05935
   49    33 S   CT   _C14    60     1.56088   114.01923  -170.98252
   50    49 S   HC   _H3_    61     1.09863   110.71275  -102.58112
   51    48 S   CA   _C10    43     1.38962   120.65848     0.97317
   52    51 S   HA   _H10    44     1.08589   121.69690   179.20058
   53    48 S   SY   _S1_    47     1.76689   119.28575   179.15977
   54    53 S   OY   _O33    48     1.45023   107.95529  -163.58751
   55    53 S   OY   _O34    49     1.45011   107.48948   -32.12383
   56    49 S   CA   _C15    62     1.51878   118.46802    22.80788
   57    37 S   CA   _C9_    45     1.41294   119.51126    57.11251
   58    57 S   HA   _H9_    46     1.08863   120.31013     0.19782
   59    53 S   CT   _C4_    50     1.77356   103.42255    82.28838
   60    59 S   HC   _H4_    51     1.09218   108.06159   179.57803
   61    59 S   HC   _H5_    52     1.09158   109.17529   -61.02548
   62    59 S   HC   _H6_    53     1.09169   109.04336    60.21052
   63    56 S   CA   _C16    63     1.40507   118.96111  -102.45370
   64    63 S   HA   _H13    64     1.08763   120.34892    -1.29241
   65    63 S   CA   _C17    65     1.39632   120.86058   178.12435
   66    65 S   HA   _H14    66     1.08621   119.93560  -179.81129
   67    65 S   CA   _C18    67     1.39225   120.06598    -0.12820
   68    67 S   HA   _H15    68     1.08604   120.15943  -179.69999
   69    67 S   CA   _C19    69     1.39234   119.83823     0.17804
   70    69 S   HA   _H16    70     1.08672   119.91274  -179.76593
   71    56 S   CA   _C20    71     1.40391   122.70698    75.63765
   72    71 S   HA   _H17    72     1.08643   121.06551     1.72010
  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
  18   2   1   1  17  10   4   3   9   4   5   9   3   6   3  11
   9   3   7   3   7   5   4   9   1   1   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    57    38    39    40    43    46    49    50    56  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    44    51    57    58    38    39    40    43    46    47    49    50    56    63    71  
   35    36  
   36  
    0  
   41    42    44    45    48    51    52    57    58    38    39    40    43    46    49    50    56  
   39    40    43    46    47    49    50    56    41    57  
   40    43    46    49  
   43    46    49  
   42    44    45    48    51    57    58    53    49  
   44    45    48    57  
   46    47    49    50    56  
   45    48    51    52    57    53    54    55    59  
   48    51    53  
   47    49    50    56    63    71  
   49    50    56  
   51    52    57    58    53    54    55    59    60    61    62  
   50    56    63    64    65    69    71    72    57  
   56    63    71  
   52    57    58    53    54    55    59  
   57    58    53  
   54    55    59    60    61    62    57  
   55    59    60    61    62  
   59    60    61    62  
   63    64    65    66    67    69    70    71    72  
   58  
    0  
   60    61    62  
   61    62  
   62  
    0  
   64    65    66    67    68    69    71    72  
   65    66    67    71  
   66    67    68    69    70    71  
   67    68    69  
   68    69    70    71    72  
   69    70    71  
   70    71    72  
   71    72  
   72  
    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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.5500   0.0700   0.138000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.2500   0.862400   2.0025   1.7750   0.025682759  -1.666211680
   54   2.9600   0.1700  -0.530000   1.6780   1.4800   0.001000000  -0.126889456
   55   2.9600   0.1700  -0.530000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5000   0.0660  -0.476500   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.178700   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.178700   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.178700   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   268.000  1.529
   33    49   268.000  1.529
   37    41   469.000  1.400
   37    57   469.000  1.400
   41    42   367.000  1.080
   41    44   469.000  1.400
   44    45   367.000  1.080
   44    48   469.000  1.400
   48    51   469.000  1.400
   48    53   225.000  1.779
   51    52   367.000  1.080
   51    57   469.000  1.400
   57    58   367.000  1.080
   53    54   735.000  1.471
   53    55   735.000  1.471
   53    59   205.000  1.840
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   320.000  1.410
   43    46   214.000  1.327
   46    47   570.000  1.229
   46    49   317.000  1.522
   49    50   340.000  1.090
   49    56   317.000  1.510
   56    63   469.000  1.400
   56    71   469.000  1.400
   63    64   367.000  1.080
   63    65   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
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    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    49    75.00000  111.63000
   33    37    41    70.00000  120.00000
   33    37    57    70.00000  120.00000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    50.00000  109.50000
   33    49    46    63.00000  111.10000
   33    49    50    37.50000  110.70000
   33    49    56    70.00000  112.17500
   37    41    42    35.00000  120.00000
   37    41    44    63.00000  120.00000
   37    57    51    63.00000  120.00000
   37    57    58    35.00000  120.00000
   41    44    45    35.00000  120.00000
   41    44    48    63.00000  120.00000
   44    41    42    35.00000  120.00000
   44    48    51    63.00000  120.00000
   44    48    53    65.00000  117.06700
   48    44    45    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    57    63.00000  120.00000
   48    53    54   100.00000  107.67100
   48    53    55   100.00000  107.67100
   48    53    59    80.00000  103.86900
   51    57    58    35.00000  120.00000
   57    37    41    63.00000  120.00000
   57    51    52    35.00000  120.00000
   53    48    51    65.00000  117.06700
   53    59    60    45.00000  108.39800
   53    59    61    45.00000  108.39800
   53    59    62    45.00000  108.39800
   55    53    54   115.00000  120.17200
   59    53    54   100.00000  108.55000
   59    53    55   100.00000  108.55000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   38    33    37    70.00000  112.17500
   38    43    46    83.00000  116.90000
   40    38    39    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    40    35.00000  109.50000
   43    46    47    83.00000  123.40000
   43    46    49    81.00000  111.40000
   46    49    50    35.00000  109.50000
   46    49    56    70.00000  110.93000
   49    33    37    70.00000  112.17500
   49    33    38    58.35000  112.70000
   49    46    47    80.00000  120.40000
   49    56    63    70.00000  120.00000
   49    56    71    70.00000  120.00000
   56    49    50    35.00000  109.50000
   56    63    64    35.00000  120.00000
   56    63    65    63.00000  120.00000
   56    71    69    63.00000  120.00000
   56    71    72    35.00000  120.00000
   63    65    66    35.00000  120.00000
   63    65    67    63.00000  120.00000
   65    63    64    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
   71    56    63    63.00000  120.00000
   71    69    70    35.00000  120.00000
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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41  -0.16000  1.0 1.0
   29    33    37    41  -0.03200 -1.0 2.0
   29    33    37    41   0.04500  1.0 3.0
   29    33    37    57  -0.16000  1.0 1.0
   29    33    37    57  -0.03200 -1.0 2.0
   29    33    37    57   0.04500  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    49    46   0.56750  1.0 1.0
   29    33    49    46  -0.07550 -1.0 2.0
   29    33    49    46   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    56   0.56750  1.0 1.0
   29    33    49    56  -0.07550 -1.0 2.0
   29    33    49    56   0.20000  1.0 3.0
   33    37    41    42   3.62500 -1.0 2.0
   33    37    41    44   3.62500 -1.0 2.0
   33    37    57    51   3.62500 -1.0 2.0
   33    37    57    58   3.62500 -1.0 2.0
   33    38   -43    46  -0.25900  1.0 1.0
   33    38   -43    46  -0.47000 -1.0 2.0
   33    38   -43    46   0.11750  1.0 3.0
   33    49    56    63   0.04150 -1.0 2.0
   33    49    56    71   0.04150 -1.0 2.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    40   0.43200  1.0 3.0
   37    33    38    43  -0.64350  1.0 1.0
   37    33    38    43  -0.04200 -1.0 2.0
   37    33    38    43   0.19800  1.0 3.0
   37    33    49    46   0.56750  1.0 1.0
   37    33    49    46  -0.07550 -1.0 2.0
   37    33    49    46   0.20000  1.0 3.0
   37    33    49    50   0.43200  1.0 3.0
   37    33    49    56  -0.94300  1.0 1.0
   37    33    49    56   1.32550 -1.0 2.0
   37    33    49    56  -0.07100  1.0 3.0
   37    41    44    45   3.62500 -1.0 2.0
   37    41    44    48   3.62500 -1.0 2.0
   41    37    57    51   3.62500 -1.0 2.0
   41    37    57    58   3.62500 -1.0 2.0
   41    44   -48    51   3.62500 -1.0 2.0
   41    44    48    53   3.62500 -1.0 2.0
   42    41    44    45   3.62500 -1.0 2.0
   42    41    44    48   3.62500 -1.0 2.0
   44    48    51    52   3.62500 -1.0 2.0
   44    48    51    57   3.62500 -1.0 2.0
   44    48    53    54   0.19500  1.0 1.0
   44    48    53    54   0.12000 -1.0 2.0
   44    48    53    55   0.19500  1.0 1.0
   44    48    53    55   0.12000 -1.0 2.0
   44    48    53    59   0.07000  1.0 1.0
   44    48    53    59  -0.56050 -1.0 2.0
   44    48    53    59   0.52800  1.0 3.0
   45    44    48    51   3.62500 -1.0 2.0
   45    44    48    53   3.62500 -1.0 2.0
   48    51   -57    37   3.62500 -1.0 2.0
   48    51    57    58   3.62500 -1.0 2.0
   48    53    59    60   0.00000  1.0 1.0
   48    53    59    61   0.00000  1.0 1.0
   48    53    59    62   0.00000  1.0 1.0
   51    48    53    54   0.19500  1.0 1.0
   51    48    53    54   0.12000 -1.0 2.0
   51    48    53    55   0.19500  1.0 1.0
   51    48    53    55   0.12000 -1.0 2.0
   51    48    53    59   0.07000  1.0 1.0
   51    48    53    59  -0.56050 -1.0 2.0
   51    48    53    59   0.52800  1.0 3.0
   52    51    57    37   3.62500 -1.0 2.0
   52    51    57    58   3.62500 -1.0 2.0
   57    37    41    42   3.62500 -1.0 2.0
   57    37   -41    44   3.62500 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    57   3.62500 -1.0 2.0
   54    53    59    60   0.26000  1.0 3.0
   54    53    59    61   0.26000  1.0 3.0
   54    53    59    62   0.26000  1.0 3.0
   55    53    59    60   0.26000  1.0 3.0
   55    53    59    61   0.26000  1.0 3.0
   55    53    59    62   0.26000  1.0 3.0
   38    33    37    41   0.04150 -1.0 2.0
   38    33    37    57   0.04150 -1.0 2.0
   38    33   -49    46  -0.95700  1.0 1.0
   38    33   -49    46  -0.18200 -1.0 2.0
   38    33   -49    46   0.29450  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    56  -0.03700  1.0 1.0
   38    33    49    56   0.37200 -1.0 2.0
   38    33    49    56  -0.47300  1.0 3.0
   38    43    46    47   3.00000 -1.0 2.0
   38    43   -46    49   1.63150  1.0 1.0
   38    43   -46    49   2.92000 -1.0 2.0
   39    38    43    46   0.08050  1.0 3.0
   40    38    43    46   0.08050  1.0 3.0
   43    46   -49    33   0.36750  1.0 3.0
   43    46    49    50   0.00000  1.0 1.0
   43    46    49    56   0.40000  1.0 3.0
   46    49    56    63   0.04300 -1.0 2.0
   46    49    56    71   0.04300 -1.0 2.0
   47    46    49    33   0.30150 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    56   0.30150 -1.0 2.0
   49    33    37    41   0.04150 -1.0 2.0
   49    33    37    57   0.04150 -1.0 2.0
   49    33    38    39   0.15000  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33   -38    43   0.62750  1.0 1.0
   49    33   -38    43  -0.30950 -1.0 2.0
   49    33   -38    43   0.27300  1.0 3.0
   49    56    63    64   3.62500 -1.0 2.0
   49    56    63    65   3.62500 -1.0 2.0
   49    56    71    69   3.62500 -1.0 2.0
   49    56    71    72   3.62500 -1.0 2.0
   50    49    56    63   0.00000  1.0 1.0
   50    49    56    71   0.00000  1.0 1.0
   56    63    65    66   3.62500 -1.0 2.0
   56    63    65    67   3.62500 -1.0 2.0
   63    56    71    69   3.62500 -1.0 2.0
   63    56    71    72   3.62500 -1.0 2.0
   63    65    67    68   3.62500 -1.0 2.0
   63    65   -67    69   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   64    63    65    67   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    56   3.62500 -1.0 2.0
   67    69    71    72   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
   70    69    71    56   3.62500 -1.0 2.0
   70    69    71    72   3.62500 -1.0 2.0
   71    56    63    64   3.62500 -1.0 2.0
   71    56   -63    65   3.62500 -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
   41    57    37    33   4.00000 -1.0 2.0
   44    42    41    37   1.10000 -1.0 2.0
   48    45    44    41   1.10000 -1.0 2.0
   51    53    48    44   4.00000 -1.0 2.0
   57    52    51    48   1.10000 -1.0 2.0
   51    58    57    37   1.10000 -1.0 2.0
   43    49    46    47  10.50000 -1.0 2.0
   63    71    56    49   4.00000 -1.0 2.0
   65    64    63    56   1.10000 -1.0 2.0
   67    66    65    63   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
   69    72    71    56   1.10000 -1.0 2.0
END
