* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    129    209     381
    1     0 S   NP   _N1_     1    28.95086    93.04362   -21.38982
    2     1 S   H    _HN1     2     1.02803    97.29203   -66.67673
    3     1 S   H    _H1_     3     1.02945    93.88453    41.72442
    4     1 S   H    _H2_     4     1.02761    21.26085   171.12066
    5     1 S   CT   _CA1     5     1.50139   132.20896   164.04645
    6     5 S   HC   _HA1     6     1.09571   105.18587    61.41617
    7     5 S   CO3  _C1_     7     1.53754   112.65379   -58.78789
    8     7 S   O2Z  _O11     8     1.26330   115.18361   -41.94524
    9     7 S   O2Z  _O12     9     1.26282   114.90407   137.22940
   10     5 S   CT   _CB1    10     1.52928   107.25397   179.14935
   11    10 S   HC   HB11    11     1.09802   109.05550   -50.49285
   12    10 S   HC   HB12    12     1.09622   110.21776    65.96153
   13    10 S   CT   _CG1    13     1.53008   113.26306  -172.30994
   14    13 S   HC   HG11    14     1.09581   110.24009   -66.64266
   15    13 S   HC   HG12    15     1.09621   110.33267    52.74301
   16    13 S   C    _CD1    16     1.51789   111.71161   172.37728
   17    16 S   O    _OE1    17     1.22695   123.02674   -15.25028
   18    16 S   N    _N2_    18     1.38526   112.30806   166.16243
   19    18 S   H    _HN2    19     1.01578   119.22629     0.49337
   20    18 S   CT1  _CA2    20     1.46195   122.81407   178.59277
   21    20 S   HC   _HA2    21     1.09635   109.13440   -10.57382
   22    20 S   C    _C2_    22     1.53419   108.45245  -125.73304
   23    22 S   O    _O2_    23     1.23044   122.38576  -147.88427
   24    20 S   CT   _CB2    32     1.53409   111.90869   111.78347
   25    24 S   HC   HB21    33     1.09660   109.51109    59.10015
   26    24 S   HC   HB22    34     1.09563   111.10733   176.32944
   27    22 S   N    _N3_    24     1.38391   113.54025    39.50187
   28    27 S   H    _HN3    25     1.01653   119.48438    -3.28468
   29    24 S   S    _SG2    35     1.82294   113.97764   -60.39583
   30    27 S   CT   _CA3    26     1.45290   123.02207   176.92827
   31    30 S   HC   HA31    27     1.09556   107.47419   -64.53580
   32    30 S   HC   HA32    28     1.09562   107.97242    51.83140
   33    29 S   CO4  _C22    36     1.76803   101.33478   -72.18000
   34    33 S   O    _O38    37     1.22589   122.19407   -12.49009
   35    30 S   CO3  _C3_    29     1.52909   114.25390   173.85009
   36    35 S   O2Z  _O31    30     1.26344   116.09878    -1.37473
   37    35 S   O2Z  _O32    31     1.26443   114.39445   178.71138
   38    33 S   CT   _C21    38     1.51400   115.03892   171.23314
   39    38 S   HC   _H14    39     1.09610   108.50989   168.80163
   40    38 S   HC   _H15    40     1.09798   108.50238    55.92112
   41    38 S   CA   _C10    41     1.51155   114.37126   -68.10048
   42    41 S   CA   _C9_    42     1.39305   118.56885    97.30504
   43    42 S   HA   _H6_    43     1.09018   118.65878     0.80503
   44    42 S   CA   _C8_    44     1.39754   121.94460  -178.77635
   45    44 S   CA   _C7_    45     1.40335   117.95717   179.42631
   46    45 S   HA   _H5_    46     1.09148   118.92645     0.54680
   47    44 S   CA   _C13    57     1.41646   120.93830    -0.10653
   48    45 S   CA   _C6_    47     1.39942   122.58592  -179.06875
   49    47 S   CA   _C12    58     1.45643   119.36790    -0.76515
   50    49 S   OM   _O35    59     1.28350   122.32946  -179.77794
   51    48 S   CA   _C5_    48     1.40637   119.63680   179.79826
   52    51 S   HA   _H4_    49     1.08863   120.44127     0.22381
   53    41 S   CA   _C11    60     1.40473   123.83356   -82.45800
   54    51 S   CA   _C4_    50     1.39154   121.20493  -179.48718
   55    54 S   HA   _H3_    51     1.08587   120.11157   179.80021
   56    53 S   CO4  _C18    61     1.48798   117.36415    -2.05881
   57    56 S   O    _O36    62     1.22610   119.69301    78.27571
   58    54 S   CA   _C17    52     1.38615   119.61474     0.13706
   59    58 S   HA   _H7_    53     1.08615   119.30911   179.58693
   60    56 S   CT   _C19    63     1.51202   116.72497  -102.00777
   61    60 S   HC   _H10    64     1.09599   110.05150    25.87957
   62    60 S   HC   _H11    65     1.09485   108.39065   -91.66963
   63    58 S   CA   _C16    54     1.39834   119.62044    -0.10835
   64    60 S   C    _C20    66     1.50975   112.96530   145.55676
   65    64 S   O    _O37    67     1.22858   122.48926   -68.19023
   66    48 S   CA   _C15    55     1.40739   119.76194     0.18345
   67    64 S   N    _N4_    68     1.37352   114.13148   111.12947
   68    67 S   H    _H12    69     1.01420   122.73629    -0.85272
   69    67 S   H    _H13    70     1.01382   120.27088  -179.49565
   70    63 S   OH   _O33    73     1.37323   117.81932   179.20722
   71    70 S   HO   _H8_    74     0.97184   109.15958     3.83533
   72    66 S   CA   _C14    56     1.43131   116.92529    -0.44411
   73    72 S   OH   _O34    71     1.38256   115.90651   179.13227
   74    73 S   HO   _H9_    72     0.97482   107.93704   177.85278
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   6   5   4   3
   7   4   2   1   1   9   4   3  11  10   4  11  10   4  10  10
   8   3   8   4   7   6   3   7   4   6   3   7   4   3   5   4
   3   5   2   1   1   2   1   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    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    53  
   38    39    40    41  
   36    37  
   37  
    0  
   39    40    41    42    43    44    49    53    56  
   40    41    42    53  
   41    42    53  
   42    43    44    45    47    49    50    53    56    57    60  
   43    44    45    46    48    72    47    49    53    56  
   44    45    47    53  
   45    46    48    51    66    72    47    49    50    53    73  
   46    48    51    52    54    63    66    72    47    49  
   48    51    66    47  
   49    50    53    56    73    74    48    63    66    72  
   51    52    54    55    58    63    66    72    73    70  
   50    53    56    57    60    73    66    72  
   53    56    72  
   52    54    55    58    59    63    66    72  
   54    55    58    66  
   56    57    60    61    62    64    72  
   55    58    59    63    66    70  
   58    59    63  
   57    60    61    62    64    65    67  
   60    61    62    64  
   59    63    66    72    70    71  
   63    66    70  
   61    62    64    65    67    68    69  
   62    64    65    67  
   64    65    67  
   66    72    73    70    71  
   65    67    68    69  
   67    68    69  
   72    73    74    70    71  
   68    69  
   69  
    0  
   71    72  
    0  
   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  -0.219900   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   3.7500   0.1050   0.482400   2.1120   1.8750   0.001000000  -0.126889456
   34   2.9600   0.2100  -0.430000   1.6780   1.4800   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   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   64   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   66   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   67   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   68   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   69   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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   210.000  1.799
   33    34   570.000  1.229
   33    38   317.000  1.522
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.510
   41    42   469.000  1.400
   41    53   469.000  1.400
   42    43   367.000  1.080
   42    44   469.000  1.400
   44    45   469.000  1.400
   44    47   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    66   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    55   367.000  1.080
   54    58   469.000  1.400
   58    59   367.000  1.080
   58    63   469.000  1.400
   63    66   469.000  1.400
   63    70   450.000  1.364
   66    72   469.000  1.400
   72    47   469.000  1.400
   72    73   450.000  1.364
   47    49   469.000  1.400
   49    50   450.000  1.364
   49    53   469.000  1.400
   53    56   310.000  1.470
   56    57   570.000  1.229
   56    60   317.000  1.522
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    64   317.000  1.522
   64    65   570.000  1.229
   64    67   490.000  1.335
   67    68   434.000  1.010
   67    69   434.000  1.010
   73    74   553.000  0.945
   70    71   553.000  0.945
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    90.00000   96.72000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    80.00000  121.30200
   29    33    38    70.00000  114.16300
   33    38    39    35.00000  109.50000
   33    38    40    35.00000  109.50000
   33    38    41    70.00000  110.93000
   38    33    34    80.00000  120.40000
   38    41    42    70.00000  120.00000
   38    41    53    70.00000  120.00000
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    42    43    35.00000  120.00000
   41    42    44    63.00000  120.00000
   41    53    49    63.00000  120.00000
   41    53    56    60.00000  119.52600
   42    44    45    63.00000  120.00000
   42    44    47    63.00000  120.00000
   44    42    43    35.00000  120.00000
   44    45    46    35.00000  120.00000
   44    45    48    63.00000  120.00000
   44    47    72    63.00000  120.00000
   44    47    49    63.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    66    63.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    54    63.00000  120.00000
   48    66    63    63.00000  120.00000
   48    66    72    63.00000  120.00000
   51    54    55    35.00000  120.00000
   51    54    58    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    58    59    35.00000  120.00000
   54    58    63    63.00000  120.00000
   58    54    55    35.00000  120.00000
   58    63    66    63.00000  120.00000
   58    63    70    70.00000  120.00000
   63    58    59    35.00000  120.00000
   63    66    72    63.00000  120.00000
   63    70    71    35.00000  113.00000
   66    48    51    63.00000  120.00000
   66    72    47    63.00000  120.00000
   66    72    73    70.00000  120.00000
   72    47    49    63.00000  120.00000
   72    73    74    35.00000  113.00000
   47    44    45    63.00000  120.00000
   47    49    50    70.00000  120.00000
   47    49    53    63.00000  120.00000
   49    53    56    60.00000  119.52600
   53    41    42    63.00000  120.00000
   53    49    50    70.00000  120.00000
   53    56    57    75.00000  123.78400
   53    56    60    65.00000  115.47100
   56    60    61    35.00000  109.50000
   56    60    62    35.00000  109.50000
   56    60    64    70.00000  107.85200
   60    56    57    80.00000  120.40000
   60    64    65    80.00000  120.40000
   60    64    67    70.00000  116.60000
   62    60    61    33.00000  107.80000
   64    60    61    35.00000  109.50000
   64    60    62    35.00000  109.50000
   64    67    68    35.00000  119.80000
   64    67    69    35.00000  119.80000
   67    64    65    80.00000  122.90000
   69    67    68    35.00000  120.00000
   73    72    47    70.00000  120.00000
   70    63    66    70.00000  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   0.00000  1.0 1.0
   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  -0.11550  1.0 1.0
   24    29    33    34   1.88700 -1.0 2.0
   24    29    33    38  -0.11550  1.0 1.0
   24    29    33    38   1.88700 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    40   0.00000  1.0 1.0
   29    33    38    41   0.00000  1.0 1.0
   33    38    41    42   0.04300 -1.0 2.0
   33    38    41    53   0.04300 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    41   0.30150 -1.0 2.0
   38    41    42    43   3.62500 -1.0 2.0
   38    41    42    44   3.62500 -1.0 2.0
   38    41    53    49   3.62500 -1.0 2.0
   38    41    53    56   3.62500 -1.0 2.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    53   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    53   0.00000  1.0 1.0
   41    42    44    45   3.62500 -1.0 2.0
   41    42    44    47   3.62500 -1.0 2.0
   41    53    56    57   1.05000 -1.0 2.0
   41    53    56    60   2.26350  1.0 1.0
   41    53    56    60   0.76750 -1.0 2.0
   41    53    56    60   0.22500  1.0 3.0
   42    41    53    49   3.62500 -1.0 2.0
   42    41    53    56   3.62500 -1.0 2.0
   42    44    45    46   3.62500 -1.0 2.0
   42    44    45    48   3.62500 -1.0 2.0
   42    44    47    72   3.62500 -1.0 2.0
   42    44   -47    49   3.62500 -1.0 2.0
   43    42    44    45   3.62500 -1.0 2.0
   43    42    44    47   3.62500 -1.0 2.0
   44    45    48    51   3.62500 -1.0 2.0
   44    45    48    66   3.62500 -1.0 2.0
   44    47    49    50   3.62500 -1.0 2.0
   44    47    49    53   3.62500 -1.0 2.0
   45    44    47    72   3.62500 -1.0 2.0
   45    44    47    49   3.62500 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    54   3.62500 -1.0 2.0
   45    48    66    63   3.62500 -1.0 2.0
   45    48   -66    72   3.62500 -1.0 2.0
   46    45    48    51   3.62500 -1.0 2.0
   46    45    48    66   3.62500 -1.0 2.0
   48    51    54    55   3.62500 -1.0 2.0
   48    51    54    58   3.62500 -1.0 2.0
   48    66    72    47   3.62500 -1.0 2.0
   48    66    72    73   3.62500 -1.0 2.0
   51    48    66    63   3.62500 -1.0 2.0
   51    48    66    72   3.62500 -1.0 2.0
   51    54    58    59   3.62500 -1.0 2.0
   51    54   -58    63   3.62500 -1.0 2.0
   52    51    54    55   3.62500 -1.0 2.0
   52    51    54    58   3.62500 -1.0 2.0
   54    58    63    66   3.62500 -1.0 2.0
   54    58    63    70   3.62500 -1.0 2.0
   55    54    58    59   3.62500 -1.0 2.0
   55    54    58    63   3.62500 -1.0 2.0
   58    63   -66    48   3.62500 -1.0 2.0
   58    63    66    72   3.62500 -1.0 2.0
   58    63    70    71   0.84100 -1.0 2.0
   59    58    63    66   3.62500 -1.0 2.0
   59    58    63    70   3.62500 -1.0 2.0
   63    66    72    47   3.62500 -1.0 2.0
   63    66    72    73   3.62500 -1.0 2.0
   66    48    51    52   3.62500 -1.0 2.0
   66    48   -51    54   3.62500 -1.0 2.0
   66    63    70    71   0.84100 -1.0 2.0
   66    72   -47    44   3.62500 -1.0 2.0
   66    72    47    49   3.62500 -1.0 2.0
   66    72    73    74   0.84100 -1.0 2.0
   72    47    49    50   3.62500 -1.0 2.0
   72    47    49    53   3.62500 -1.0 2.0
   47    44    45    46   3.62500 -1.0 2.0
   47    44   -45    48   3.62500 -1.0 2.0
   47    72    73    74   0.84100 -1.0 2.0
   47    49   -53    41   3.62500 -1.0 2.0
   47    49    53    56   3.62500 -1.0 2.0
   49    53    56    57   1.05000 -1.0 2.0
   49    53    56    60   2.26350  1.0 1.0
   49    53    56    60   0.76750 -1.0 2.0
   49    53    56    60   0.22500  1.0 3.0
   50    49    53    41   3.62500 -1.0 2.0
   50    49    53    56   3.62500 -1.0 2.0
   53    41    42    43   3.62500 -1.0 2.0
   53    41   -42    44   3.62500 -1.0 2.0
   53    56    60    61   0.00000  1.0 1.0
   53    56    60    62   0.00000  1.0 1.0
   53    56    60    64   0.65300  1.0 1.0
   53    56    60    64  -0.03850 -1.0 2.0
   53    56    60    64   0.33900  1.0 3.0
   56    60    64    65   0.30150 -1.0 2.0
   56    60    64    67   0.00000  1.0 1.0
   57    56    60    61   0.00000  1.0 1.0
   57    56    60    62   0.00000  1.0 1.0
   57    56    60    64   0.30150 -1.0 2.0
   60    64    67    68   2.45000 -1.0 2.0
   60    64    67    69   2.45000 -1.0 2.0
   61    60    64    65   0.00000  1.0 1.0
   61    60    64    67   0.00000  1.0 1.0
   62    60    64    65   0.00000  1.0 1.0
   62    60    64    67   0.00000  1.0 1.0
   65    64    67    68   2.45000 -1.0 2.0
   65    64    67    69   2.45000 -1.0 2.0
   73    72    47    44   3.62500 -1.0 2.0
   73    72    47    49   3.62500 -1.0 2.0
   70    63    66    48   3.62500 -1.0 2.0
   70    63    66    72   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
   36    30    35    37  10.50000 -1.0 2.0
   29    38    33    34  10.50000 -1.0 2.0
   42    53    41    38   4.00000 -1.0 2.0
   44    43    42    41   1.10000 -1.0 2.0
   45    47    44    42   4.00000 -1.0 2.0
   48    46    45    44   1.10000 -1.0 2.0
   51    66    48    45   4.00000 -1.0 2.0
   54    52    51    48   1.10000 -1.0 2.0
   58    55    54    51   1.10000 -1.0 2.0
   63    59    58    54   1.10000 -1.0 2.0
   66    70    63    58   4.00000 -1.0 2.0
   63    72    66    48   4.00000 -1.0 2.0
   47    73    72    66   4.00000 -1.0 2.0
   72    49    47    44   4.00000 -1.0 2.0
   53    50    49    47   4.00000 -1.0 2.0
   49    56    53    41   4.00000 -1.0 2.0
   53    60    56    57  10.50000 -1.0 2.0
   60    67    64    65  10.50000 -1.0 2.0
   69    64    67    68   1.00000 -1.0 2.0
END
