* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    137    220     398
    1     0 S   NP   _N1_     1    28.62172    95.06125   -23.23903
    2     1 S   H    _HN1     2     1.02952    79.92185    24.58794
    3     1 S   H    _H1_     3     1.02831    32.04701   172.35006
    4     1 S   H    _H2_     4     1.02783   101.51641   -82.28108
    5     1 S   CT   _CA1     5     1.50108   138.16793   133.99917
    6     5 S   HC   _HA1     6     1.09573   105.21935    79.81296
    7     5 S   CO3  _C1_     7     1.53792   112.44362   -40.45280
    8     7 S   O2Z  _O11     8     1.26370   115.00282   -42.99377
    9     7 S   O2Z  _O12     9     1.26238   114.94267   136.19713
   10     5 S   CT   _CB1    10     1.53089   107.43897  -162.19256
   11    10 S   HC   HB11    11     1.09830   109.39326   -49.95679
   12    10 S   HC   HB12    12     1.09815   110.43252    66.65106
   13    10 S   CT   _CG1    13     1.52984   112.59552  -170.95947
   14    13 S   HC   HG11    14     1.09595   110.59013   -64.72862
   15    13 S   HC   HG12    15     1.09668   109.84132    54.49727
   16    13 S   C    _CD1    16     1.51795   112.30053   174.95896
   17    16 S   O    _OE1    17     1.22716   123.32548     4.40211
   18    16 S   N    _N2_    18     1.38621   111.58475  -175.78592
   19    18 S   H    _HN2    19     1.01591   118.92254     2.04909
   20    18 S   CT1  _CA2    20     1.46214   123.44152   178.26291
   21    20 S   HC   _HA2    21     1.09734   109.45229    -2.64042
   22    20 S   C    _C2_    22     1.53494   108.51674  -118.09551
   23    22 S   O    _O2_    23     1.23038   122.31165  -148.57391
   24    20 S   CT   _CB2    32     1.53398   111.30331   119.52369
   25    24 S   HC   HB21    33     1.09289   109.32334    54.60301
   26    24 S   HC   HB22    34     1.09470   110.02044   173.42959
   27    22 S   N    _N3_    24     1.38347   113.58621    39.01197
   28    27 S   H    _HN3    25     1.01610   119.53239    -3.72914
   29    24 S   S    _SG2    35     1.82993   111.12468   -67.39918
   30    27 S   CT   _CA3    26     1.45290   123.18616   176.98923
   31    30 S   HC   HA31    27     1.09552   107.54814   -63.06945
   32    30 S   HC   HA32    28     1.09556   107.93064    53.35245
   33    29 S   CT   _C17    36     1.87306   103.00638   165.20716
   34    30 S   CO3  _C3_    29     1.52958   114.08645   175.26439
   35    34 S   O2Z  _O31    30     1.26379   116.04630    -2.22809
   36    34 S   O2Z  _O32    31     1.26429   114.42981   177.83445
   37    33 S   CT   _C10    37     1.56147   111.08252    38.66734
   38    37 S   HC   _H26    38     1.09920   108.81742    49.82730
   39    37 S   HC   _H27    39     1.08815   108.93357   -65.26641
   40    33 S   CT   _C16    63     1.57170   110.28624   -89.53967
   41    40 S   HC   _H33    64     1.09317   108.63644   179.80317
   42    33 S   CT   _C18    68     1.55234   103.17175   154.21253
   43    42 S   HC   _H34    69     1.09671   112.83274    53.01948
   44    42 S   HC   _H35    70     1.09701   111.55398   -67.85138
   45    42 S   HC   _H36    71     1.09584   111.05060   172.46495
   46    37 S   CT   _C14    40     1.54548   115.45259   171.13749
   47    46 S   HC   _H31    41     1.09453   111.14622    24.23551
   48    40 S   OH   _O21    65     1.43876   109.45669   -67.34149
   49    48 S   HO   _H37    66     0.97335   107.33359    57.58624
   50    46 S   CT   _C13    42     1.53845   114.41898   151.08241
   51    50 S   HC   _H30    43     1.10062   108.53967    45.04404
   52    50 S   CM   _C6_    44     1.49584    98.39436   154.95077
   53    50 S   CT   _C11    51     1.55269   116.31105   -78.22244
   54    53 S   HC   _H28    52     1.09287   113.40731  -134.86557
   55    52 S   CO4  _C8_    45     1.48266   107.85906   -28.14949
   56    55 S   O    _O17    46     1.21721   127.16879  -167.08907
   57    52 S   CM   _C9_    48     1.33569   131.14108   151.56191
   58    57 S   HC   _H24    49     1.08387   121.77201     0.98774
   59    57 S   HC   _H25    50     1.08577   121.47084  -179.75934
   60    53 S   CM   _C4_    53     1.48074   114.74849    -6.16688
   61    60 S   HC   _H23    54     1.08174   123.21051   -66.97107
   62    46 S   OS   _O19    47     1.44194   109.63622   -91.96616
   63    60 S   CM   _C5_    55     1.33364   111.62586   101.91426
   64    63 S   CO4  _C7_    56     1.47813   105.23201    11.22137
   65    64 S   O    _O16    57     1.21891   125.21847   176.74298
   66    63 S   C3T  _C12    59     1.45280   130.02765  -163.27048
   67    66 S   HC   _H29    60     1.08665   112.73726  -153.52945
   68    53 S   OS   _O18    58     1.43811   107.44725   107.24193
   69    66 S   C3T  _C15    61     1.53284   118.42844    66.37240
   70    69 S   HC   _H32    62     1.08417   116.68148   137.73243
   71    66 S   O3T  _O20    67     1.42534   125.91443    -3.45797
  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  13   5   4   3
  19   2   1   1  18   7   6  14   7   6   2   1   1  12   6   5
   1  15   8  10  11   5   5   2   3   1   1   9   4   1   8   6
   2   5   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46    69    40    41    48    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    50    62    66    69    70    40    41    48    49    71    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    50    51    52    55    62    53    69    40    41    48    42    43    44    45  
   39    46    47    50    62    40    42  
   46    47    50    62    40    42  
   41    48    49    71    42    43    44    45    46    63    66    67    69    70  
   48    49    71    42    66    69    70  
   43    44    45    46    48    69  
   44    45  
   45  
    0  
   47    50    51    52    55    56    62    57    53    54    60    68  
   50    51    52    55    62    53  
   49    71    66    69    70  
   69  
   51    52    55    56    62    57    58    59    53    54    60    61    63    64    68  
   52    55    62    57    53    54    60    68  
   55    56    62    57    58    59    53    54    60    68  
   54    60    61    63    64    65    68    66    55    57    62  
   60    61    63    64    68  
   56    62    57    58    59  
   62    57  
   58    59    62  
   59  
    0  
   61    63    64    65    68    66    67    69    71  
   63    64    68    66  
    0  
   64    65    68    66    67    69    70    71  
   65    68    66    67    69    71  
   68    66  
   67    69    70    71    68  
   69    70    71  
    0  
   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  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    40   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    46   268.000  1.529
   46    47   340.000  1.090
   46    50   268.000  1.529
   46    62   320.000  1.410
   50    51   340.000  1.090
   50    52   317.000  1.510
   50    53   268.000  1.529
   52    55   320.000  1.462
   52    57   549.000  1.340
   55    56   570.000  1.229
   55    62   214.000  1.327
   57    58   340.000  1.080
   57    59   340.000  1.080
   53    54   340.000  1.090
   53    60   317.000  1.510
   53    68   320.000  1.410
   60    61   340.000  1.080
   60    63   549.000  1.340
   63    64   320.000  1.462
   63    66   305.000  1.480
   64    65   570.000  1.229
   64    68   214.000  1.327
   66    67   340.000  1.088
   66    69   260.000  1.509
   66    71   335.000  1.432
   69    70   340.000  1.088
   69    40   275.000  1.510
   69    71   335.000  1.432
   40    41   340.000  1.090
   40    48   320.000  1.410
   48    49   553.000  0.945
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    46    58.35000  112.70000
   33    40    69    70.00000  112.37300
   33    40    41    37.50000  110.70000
   33    40    48    50.00000  109.50000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    37.50000  110.70000
   37    46    50    58.35000  112.70000
   37    46    62    50.00000  109.50000
   39    37    38    33.00000  107.80000
   46    37    38    37.50000  110.70000
   46    37    39    37.50000  110.70000
   46    50    51    37.50000  110.70000
   46    50    52    70.00000  112.02700
   46    50    53    58.35000  112.70000
   46    62    55    83.00000  116.90000
   50    46    47    37.50000  110.70000
   50    52    55    65.00000  116.34900
   50    52    57    70.00000  124.00000
   50    53    54    37.50000  110.70000
   50    53    60    70.00000  112.02700
   50    53    68    50.00000  109.50000
   52    50    51    35.00000  109.50000
   52    55    56    80.00000  123.72100
   52    55    62    90.00000  111.29400
   52    57    58    35.00000  120.00000
   52    57    59    35.00000  120.00000
   62    46    47    35.00000  109.50000
   62    46    50    50.00000  109.50000
   62    55    56    83.00000  123.40000
   57    52    55    65.00000  118.96000
   59    57    58    35.00000  117.00000
   53    50    51    37.50000  110.70000
   53    50    52    70.00000  112.02700
   53    60    61    35.00000  117.00000
   53    60    63    70.00000  124.00000
   53    68    64    83.00000  116.90000
   60    53    54    35.00000  109.50000
   60    63    64    65.00000  118.96000
   60    63    66    55.00000  125.06700
   63    60    61    35.00000  120.00000
   63    64    65    80.00000  123.72100
   63    64    68    90.00000  111.29400
   63    66    67    40.00000  112.45000
   63    66    69    60.00000  120.58800
   63    66    71    85.00000  114.23300
   68    53    54    35.00000  109.50000
   68    53    60    85.00000  110.90400
   68    64    65    83.00000  123.40000
   66    63    64    65.00000  114.68000
   66    69    70    37.50000  117.20000
   66    69    40    60.00000  120.94000
   66    69    71    15.00000   60.43100
   66    71    69    15.00000   59.14900
   69    66    67    37.50000  117.20000
   69    40    41    45.00000  109.38400
   69    40    48    50.00000  109.50000
   40    33    37    58.35000  112.70000
   40    69    70    40.00000  115.04500
   40    48    49    55.00000  108.50000
   48    40    41    35.00000  109.50000
   71    66    67    50.00000  114.27700
   71    66    69    15.00000   60.43100
   71    69    70    50.00000  114.27700
   71    69    40    80.00000  116.47100
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    46   0.44750  1.0 1.0
   29    33    37    46  -0.17800 -1.0 2.0
   29    33    37    46   0.20200  1.0 3.0
   29    33    40    69   0.44750  1.0 1.0
   29    33    40    69  -0.17800 -1.0 2.0
   29    33    40    69   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    48   0.56750  1.0 1.0
   29    33    40    48  -0.07550 -1.0 2.0
   29    33    40    48   0.20000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   0.15000  1.0 3.0
   33    37    46    50   0.56750  1.0 1.0
   33    37    46    50  -0.07550 -1.0 2.0
   33    37    46    50   0.20000  1.0 3.0
   33    37    46    62   0.62750  1.0 1.0
   33    37    46    62  -0.30950 -1.0 2.0
   33    37    46    62   0.27300  1.0 3.0
   33    40    48    49  -0.11600  1.0 1.0
   33    40    48    49  -0.09450 -1.0 2.0
   33    40    48    49   0.21250  1.0 3.0
   37    33    40    69   0.47050  1.0 1.0
   37    33    40    69   0.03900 -1.0 2.0
   37    33    40    69   0.20100  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    48   0.86500  1.0 1.0
   37    33    40    48  -0.17500 -1.0 2.0
   37    33    40    48   0.20800  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    45   0.15000  1.0 3.0
   37    46    50    51   0.15000  1.0 3.0
   37    46    50    52   0.34400  1.0 1.0
   37    46    50    52   0.09450 -1.0 2.0
   37    46    50    52   0.11100  1.0 3.0
   37    46    50    53   0.56750  1.0 1.0
   37    46    50    53  -0.07550 -1.0 2.0
   37    46    50    53   0.20000  1.0 3.0
   37    46    62    55  -0.25900  1.0 1.0
   37    46    62    55  -0.47000 -1.0 2.0
   37    46    62    55   0.11750  1.0 3.0
   38    37    46    47   0.15000  1.0 3.0
   38    37    46    50   0.15000  1.0 3.0
   38    37    46    62   0.23400  1.0 3.0
   39    37    46    47   0.15000  1.0 3.0
   39    37    46    50   0.15000  1.0 3.0
   39    37    46    62   0.23400  1.0 3.0
   46    50   -52    55   0.09700  1.0 1.0
   46    50   -52    55   0.15600 -1.0 2.0
   46    50   -52    55  -0.50800  1.0 3.0
   46    50    52    57   0.09850  1.0 1.0
   46    50    52    57   0.15250 -1.0 2.0
   46    50    52    57  -0.50650  1.0 3.0
   46    50    53    54   0.15000  1.0 3.0
   46    50    53    60   0.34400  1.0 1.0
   46    50    53    60   0.09450 -1.0 2.0
   46    50    53    60   0.11100  1.0 3.0
   46    50    53    68   0.62750  1.0 1.0
   46    50    53    68  -0.30950 -1.0 2.0
   46    50    53    68   0.27300  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    52   0.15000  1.0 3.0
   47    46    50    53   0.15000  1.0 3.0
   47    46    62    55   0.08050  1.0 3.0
   50    46   -62    55  -0.25900  1.0 1.0
   50    46   -62    55  -0.47000 -1.0 2.0
   50    46   -62    55   0.11750  1.0 3.0
   50    52    55    56  -0.64400  1.0 1.0
   50    52    55    56   0.26850 -1.0 2.0
   50    52   -55    62  -0.15000  1.0 1.0
   50    52   -55    62   0.89550 -1.0 2.0
   50    52   -55    62  -0.06900  1.0 3.0
   50    52    57    58   7.00000 -1.0 2.0
   50    52    57    59   7.00000 -1.0 2.0
   50    53    60    61   0.00000  1.0 1.0
   50    53    60    63   0.09850  1.0 1.0
   50    53    60    63   0.15250 -1.0 2.0
   50    53    60    63  -0.50650  1.0 3.0
   50    53    68    64  -0.25900  1.0 1.0
   50    53    68    64  -0.47000 -1.0 2.0
   50    53    68    64   0.11750  1.0 3.0
   51    50    52    55   0.15000  1.0 3.0
   51    50    52    57   0.00000  1.0 1.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    60   0.15000  1.0 3.0
   51    50    53    68   0.23400  1.0 3.0
   52    50    53    54   0.15000  1.0 3.0
   52    50    53    60   0.31000  1.0 1.0
   52    50    53    60   0.14700 -1.0 2.0
   52    50    53    60   0.07550  1.0 3.0
   52    50    53    68   0.61850  1.0 1.0
   52    50    53    68  -0.22750 -1.0 2.0
   52    50    53    68   0.15300  1.0 3.0
   52    55   -62    46   2.00000 -1.0 2.0
   55    52    57    58   7.00000 -1.0 2.0
   55    52    57    59   7.00000 -1.0 2.0
   56    55    62    46   3.00000 -1.0 2.0
   62    46    50    51   0.23400  1.0 3.0
   62    46   -50    52   0.61850  1.0 1.0
   62    46   -50    52  -0.22750 -1.0 2.0
   62    46   -50    52   0.15300  1.0 3.0
   62    46    50    53   0.62750  1.0 1.0
   62    46    50    53  -0.30950 -1.0 2.0
   62    46    50    53   0.27300  1.0 3.0
   57    52    55    56   1.00000 -1.0 2.0
   57    52    55    62  -0.56150  1.0 1.0
   57    52    55    62   2.19150 -1.0 2.0
   53    50    52    55   0.09700  1.0 1.0
   53    50    52    55   0.15600 -1.0 2.0
   53    50    52    55  -0.50800  1.0 3.0
   53    50    52    57   0.09850  1.0 1.0
   53    50    52    57   0.15250 -1.0 2.0
   53    50    52    57  -0.50650  1.0 3.0
   53    60   -63    64   7.00000 -1.0 2.0
   53    60    63    66   7.00000 -1.0 2.0
   54    53    60    61   0.33100  1.0 3.0
   54    53    60    63   0.00000  1.0 1.0
   54    53    68    64   0.08050  1.0 3.0
   60    53   -68    64  -0.82050  1.0 1.0
   60    53   -68    64   0.00600 -1.0 2.0
   60    53   -68    64   0.04400  1.0 3.0
   60    63    64    65   1.00000 -1.0 2.0
   60    63   -64    68  -0.56150  1.0 1.0
   60    63   -64    68   2.19150 -1.0 2.0
   60    63    66    67   0.00000  1.0 1.0
   60    63    66    69   0.09850  1.0 1.0
   60    63    66    69   0.15250 -1.0 2.0
   60    63    66    69  -0.50650  1.0 3.0
   60    63    66    71   0.39000  1.0 1.0
   60    63    66    71  -0.05800 -1.0 2.0
   60    63    66    71  -0.55150  1.0 3.0
   61    60    63    64   7.00000 -1.0 2.0
   61    60    63    66   7.00000 -1.0 2.0
   63    64   -68    53   2.00000 -1.0 2.0
   63    66    69    70   0.15000  1.0 3.0
   63    66    69    40   0.34400  1.0 1.0
   63    66    69    40   0.09450 -1.0 2.0
   63    66    69    40   0.11100  1.0 3.0
   63    66   -69    71   0.61850  1.0 1.0
   63    66   -69    71  -0.22750 -1.0 2.0
   63    66   -69    71   0.15300  1.0 3.0
   63    66   -71    69  -0.77900  1.0 1.0
   63    66   -71    69  -0.36900 -1.0 2.0
   63    66   -71    69   0.40400  1.0 3.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    69   0.09700  1.0 1.0
   64    63    66    69   0.15600 -1.0 2.0
   64    63    66    69  -0.50800  1.0 3.0
   64    63    66    71   0.09700  1.0 1.0
   64    63    66    71   0.15600 -1.0 2.0
   64    63    66    71  -0.50800  1.0 3.0
   65    64    68    53   3.00000 -1.0 2.0
   68    53    60    61   0.00000  1.0 1.0
   68    53   -60    63   0.39000  1.0 1.0
   68    53   -60    63  -0.05800 -1.0 2.0
   68    53   -60    63  -0.55150  1.0 3.0
   66    63    64    65  -0.64400  1.0 1.0
   66    63    64    65   0.26850 -1.0 2.0
   66    63    64    68  -0.15000  1.0 1.0
   66    63    64    68   0.89550 -1.0 2.0
   66    63    64    68  -0.06900  1.0 3.0
   66    69    40    33   0.07850  1.0 1.0
   66    69    40    33  -0.03950 -1.0 2.0
   66    69    40    33   0.67350  1.0 3.0
   66    69    40    41   0.15000  1.0 3.0
   66    69    40    48   0.86500  1.0 1.0
   66    69    40    48  -0.17500 -1.0 2.0
   66    69    40    48   0.20800  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   67    66    69    40   0.15000  1.0 3.0
   67    66   -69    71   0.23400  1.0 3.0
   67    66   -71    69   0.36800  1.0 3.0
   69    40    48    49  -0.11600  1.0 1.0
   69    40    48    49  -0.09450 -1.0 2.0
   69    40    48    49   0.21250  1.0 3.0
   70    69    40    33   0.15000  1.0 3.0
   70    69    40    41   0.15000  1.0 3.0
   70    69    40    48   0.23400  1.0 3.0
   70    69   -71    66   0.36800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    46   0.56750  1.0 1.0
   40    33    37    46  -0.07550 -1.0 2.0
   40    33    37    46   0.20000  1.0 3.0
   40    33    42    43   0.15000  1.0 3.0
   40    33    42    44   0.15000  1.0 3.0
   40    33    42    45   0.15000  1.0 3.0
   40    69   -71    66   0.06250  1.0 1.0
   40    69   -71    66  -0.01100 -1.0 2.0
   40    69   -71    66   0.28050  1.0 3.0
   41    40    48    49   0.19450  1.0 3.0
   71    66   -69    70   0.23400  1.0 3.0
   71    66   -69    40   0.02550  1.0 1.0
   71    66   -69    40  -0.02600 -1.0 2.0
   71    66   -69    40   1.20400  1.0 3.0
   71    69    40    33   0.02550  1.0 1.0
   71    69    40    33  -0.02600 -1.0 2.0
   71    69    40    33   1.20400  1.0 3.0
   71    69    40    41   0.23400  1.0 3.0
   71    69    40    48   3.69350  1.0 1.0
   71    69    40    48  -1.82950 -1.0 2.0
   42    33    37    38   0.15000  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    46   0.56750  1.0 1.0
   42    33    37    46  -0.07550 -1.0 2.0
   42    33    37    46   0.20000  1.0 3.0
   42    33    40    69   0.47050  1.0 1.0
   42    33    40    69   0.03900 -1.0 2.0
   42    33    40    69   0.20100  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
   42    33    40    48   0.86500  1.0 1.0
   42    33    40    48  -0.17500 -1.0 2.0
   42    33    40    48   0.20800  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   50    55    52    57   1.10000 -1.0 2.0
   52    62    55    56  10.50000 -1.0 2.0
   58    59    57    52   1.10000 -1.0 2.0
   53    61    60    63   1.10000 -1.0 2.0
   64    66    63    60   1.10000 -1.0 2.0
   63    68    64    65  10.50000 -1.0 2.0
END
