* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    144    233     433
    1     0 S   NP   _N1_     1    29.40639    92.00478   -22.98955
    2     1 S   H    _HN1     2     1.02773   103.48156   -81.16299
    3     1 S   H    _H1_     3     1.02966    96.27678    29.43877
    4     1 S   H    _H2_     4     1.02827    14.33472   168.83886
    5     1 S   CT   _CA1     5     1.50152   124.37112   149.33096
    6     5 S   HC   _HA1     6     1.09580   105.19240    64.20996
    7     5 S   CO3  _C1_     7     1.53781   112.44381   -55.82244
    8     7 S   O2Z  _O11     8     1.26351   115.01740   -41.48547
    9     7 S   O2Z  _O12     9     1.26254   114.91709   137.57069
   10     5 S   CT   _CB1    10     1.53074   107.35541  -178.00325
   11    10 S   HC   HB11    11     1.09821   109.16301   -51.45290
   12    10 S   HC   HB12    12     1.09819   110.42117    64.99910
   13    10 S   CT   _CG1    13     1.53011   112.80783  -172.68493
   14    13 S   HC   HG11    14     1.09596   110.29542   -65.09818
   15    13 S   HC   HG12    15     1.09642   110.12865    54.15544
   16    13 S   C    _CD1    16     1.51791   112.25820   174.27755
   17    16 S   O    _OE1    17     1.22747   123.22149    -7.79631
   18    16 S   N    _N2_    18     1.38703   111.74072   172.91080
   19    18 S   H    _HN2    19     1.01580   119.12054     1.46794
   20    18 S   CT1  _CA2    20     1.46052   123.19353  -179.11796
   21    20 S   HC   _HA2    21     1.09578   109.23784    -6.00005
   22    20 S   C    _C2_    22     1.53459   109.03872  -121.14697
   23    22 S   O    _O2_    23     1.23045   122.01653  -148.55519
   24    20 S   CT   _CB2    32     1.53481   111.84478   116.19387
   25    24 S   HC   HB21    33     1.09659   109.54937    65.24552
   26    24 S   HC   HB22    34     1.09580   110.72189  -177.59206
   27    22 S   N    _N3_    24     1.38446   113.58521    39.02307
   28    27 S   H    _HN3    25     1.01509   118.93854    -0.90871
   29    24 S   S    _SG2    35     1.82903   115.07335   -54.51706
   30    27 S   CT   _CA3    26     1.45447   123.50064   174.77198
   31    30 S   HC   HA31    27     1.09518   109.31531    23.35084
   32    30 S   HC   HA32    28     1.09497   107.12270   140.38199
   33    29 S   CT   _C18    36     1.82648   100.02184   -65.22679
   34    33 S   HC   _H21    37     1.09459   107.49059   -60.63572
   35    33 S   HC   _H22    38     1.09196   108.70823    57.28596
   36    30 S   CO3  _C3_    29     1.52919   112.98441  -100.15907
   37    36 S   O2Z  _O31    30     1.26411   115.35661   -45.81653
   38    36 S   O2Z  _O32    31     1.26344   115.01763   135.06617
   39    33 S   CT   _C17    39     1.52719   111.01276   178.88180
   40    39 S   HC   _H7_    40     1.09872   110.81208    42.92671
   41    39 S   CO4  _C16    41     1.51870   114.32498   -78.36356
   42    41 S   O    _O34    42     1.22040   126.79854    35.45377
   43    41 S   OS   _O33    43     1.37293   109.34263  -145.77370
   44    43 S   CT   _C14    44     1.43188   109.01349    -2.61037
   45    44 S   HC   _H6_    45     1.09864   106.25501   -89.47917
   46    44 S   CT   _C15    46     1.52701   112.12326   153.04073
   47    46 S   HC   _H19    47     1.09758   109.39547    47.62328
   48    46 S   HC   _H20    48     1.09856   106.96205   162.73872
   49    39 S   CT   _C13    64     1.53564   114.72954   166.18452
   50    49 S   HC   _H5_    65     1.09694   110.84686   -84.03007
   51    46 S   CT   _C5_    49     1.55013   115.64058   -76.44752
   52    51 S   CT   _C6_    50     1.55634   108.18916  -167.68046
   53    52 S   HC   _H11    51     1.09932   109.85627    50.76012
   54    52 S   HC   _H12    52     1.09817   110.46979   -64.56448
   55    51 S   CT   _C4_    71     1.54829   109.71156    74.12086
   56    55 S   HC   _H8_    72     1.09411   112.35665   178.79862
   57    55 S   HC   _H9_    73     1.09622   110.61409    59.07690
   58    55 S   HC   _H10    74     1.09207   112.81309   -60.87998
   59    52 S   CT   _C7_    53     1.53439   113.58986   172.17336
   60    59 S   HC   _H3_    54     1.09569   110.43144    69.81419
   61    59 S   CT   _C8_    55     1.52941   111.82519   -52.68339
   62    61 S   HC   _H13    56     1.09824   109.87091   -69.61433
   63    61 S   HC   _H14    57     1.09741   109.13447   175.45748
   64    59 S   OH   _O35    69     1.42611   109.19212  -172.64241
   65    64 S   HO   _H23    70     0.97250   107.49956   -58.68945
   66    61 S   CM   _C9_    58     1.51031   111.34793    51.40160
   67    51 S   CT   _C11    59     1.55921   108.87413   -49.50542
   68    67 S   HC   _H4_    60     1.10177   107.62724   -58.22289
   69    66 S   CM   _C10    66     1.34243   120.75758   124.49942
   70    69 S   HC   _H15    67     1.08375   122.49074  -179.53396
   71    69 S   HC   _H16    68     1.08558   121.09270     0.20558
   72    67 S   CT   _C12    61     1.53854   111.25908    57.08137
   73    72 S   HC   _H17    62     1.09626   110.01177    65.13096
   74    72 S   HC   _H18    63     1.09779   109.34301  -178.53046
  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   7   5   4   3
  11   5   4   2   1   1  13   7   8   3   9  13   7  17   6   5
   8   4  18  17   7   6   8   3   2   1   9   6  11   5   4   2
   1   8   7   4   3   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    49  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    72    49    50  
   35    39    40    41    49  
   39    40    41    49  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    67    72    73    74    49    50  
   41    42    43    44    72    49    50  
   42    43    44    45    46    72    49    50  
   43    44    49  
   44    45    46    47    48    51    72    49    50  
   45    46    47    48    51    52    67    72    73    74    49    50    55  
   46    47    48    51    72    49    50  
   47    48    51    52    53    54    59    66    67    68    72    49    50    55    56    57    58  
   48    51    52    67    49    55  
   51    52    67    49    55  
   50    51    66    67    68    72    73    74  
   67    72    73    74  
   52    53    54    59    60    61    66    67    68    72    73    74    69    64    55    56    57    58  
   53    54    59    60    61    62    63    66    67    68    72    64    65    55    56    57    58  
   54    59    60    61    67    64    55  
   59    60    61    67    64    55  
   56    57    58    59    66    67    68    72  
   57    58    67  
   58    67  
   67  
   60    61    62    63    66    67    69    64    65  
   61    62    63    66    64    65  
   62    63    66    67    68    72    69    70    71    64    65  
   63    66    67    69    64  
   66    67    69    64  
   65    66  
    0  
   67    68    72    73    74    69    70    71  
   68    72    73    74    69    70    71  
   72    73    74    69  
   70    71    72  
   71  
    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  -0.335000   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    49   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   268.000  1.529
   51    67   268.000  1.529
   51    55   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    64   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   317.000  1.510
   66    67   317.000  1.510
   66    69   549.000  1.340
   67    68   340.000  1.090
   67    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    49   268.000  1.529
   49    50   340.000  1.090
   69    70   340.000  1.080
   69    71   340.000  1.080
   64    65   553.000  0.945
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    49    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    49    44    58.35000  112.70000
   39    49    72    58.35000  112.70000
   39    49    50    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    49    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    51    58.35000  112.70000
   44    49    72    58.35000  112.70000
   44    49    50    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    51    52    58.35000  112.70000
   46    51    67    58.35000  112.70000
   46    51    55    58.35000  112.70000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    52    53    37.50000  110.70000
   51    52    54    37.50000  110.70000
   51    52    59    58.35000  112.70000
   51    67    66    70.00000  112.02700
   51    67    68    37.50000  110.70000
   51    67    72    58.35000  112.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   52    59    60    37.50000  110.70000
   52    59    61    58.35000  112.70000
   52    59    64    50.00000  109.50000
   54    52    53    33.00000  107.80000
   59    52    53    37.50000  110.70000
   59    52    54    37.50000  110.70000
   59    61    62    37.50000  110.70000
   59    61    63    37.50000  110.70000
   59    61    66    70.00000  112.02700
   59    64    65    55.00000  108.50000
   61    59    60    37.50000  110.70000
   61    66    67    65.00000  117.92700
   61    66    69    70.00000  124.00000
   63    61    62    33.00000  107.80000
   66    61    62    35.00000  109.50000
   66    61    63    35.00000  109.50000
   66    67    68    35.00000  109.50000
   66    67    72    70.00000  112.02700
   66    69    70    35.00000  120.00000
   66    69    71    35.00000  120.00000
   67    51    52    58.35000  112.70000
   67    72    73    37.50000  110.70000
   67    72    74    37.50000  110.70000
   67    72    49    58.35000  112.70000
   72    67    68    37.50000  110.70000
   72    49    50    37.50000  110.70000
   74    72    73    33.00000  107.80000
   49    39    40    37.50000  110.70000
   49    39    41    63.00000  111.10000
   49    44    45    37.50000  110.70000
   49    44    46    58.35000  112.70000
   49    72    73    37.50000  110.70000
   49    72    74    37.50000  110.70000
   69    66    67    70.00000  124.00000
   71    69    70    35.00000  117.00000
   64    59    60    35.00000  109.50000
   64    59    61    50.00000  109.50000
   55    51    52    58.35000  112.70000
   55    51    67    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    49   0.44750  1.0 1.0
   29    33    39    49  -0.17800 -1.0 2.0
   29    33    39    49   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    49    44   0.56750  1.0 1.0
   33    39    49    44  -0.07550 -1.0 2.0
   33    39    49    44   0.20000  1.0 3.0
   33    39    49    72   0.56750  1.0 1.0
   33    39    49    72  -0.07550 -1.0 2.0
   33    39    49    72   0.20000  1.0 3.0
   33    39    49    50   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    49   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    49   0.15000  1.0 3.0
   39    41   -43    44   1.63150  1.0 1.0
   39    41   -43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    49    44   0.15000  1.0 3.0
   40    39    49    72   0.15000  1.0 3.0
   40    39    49    50   0.15000  1.0 3.0
   41    39   -49    44  -0.95700  1.0 1.0
   41    39   -49    44  -0.18200 -1.0 2.0
   41    39   -49    44   0.29450  1.0 3.0
   41    39    49    72  -0.95700  1.0 1.0
   41    39    49    72  -0.18200 -1.0 2.0
   41    39    49    72   0.29450  1.0 3.0
   41    39    49    50  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.25900  1.0 1.0
   41    43    44    46  -0.47000 -1.0 2.0
   41    43    44    46   0.11750  1.0 3.0
   41    43   -44    49  -0.25900  1.0 1.0
   41    43   -44    49  -0.47000 -1.0 2.0
   41    43   -44    49   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    48   0.23400  1.0 3.0
   43    44    46    51   0.62750  1.0 1.0
   43    44    46    51  -0.30950 -1.0 2.0
   43    44    46    51   0.27300  1.0 3.0
   43    44   -49    39   0.62750  1.0 1.0
   43    44   -49    39  -0.30950 -1.0 2.0
   43    44   -49    39   0.27300  1.0 3.0
   43    44    49    72   0.62750  1.0 1.0
   43    44    49    72  -0.30950 -1.0 2.0
   43    44    49    72   0.27300  1.0 3.0
   43    44    49    50   0.23400  1.0 3.0
   44    46    51    52   0.56750  1.0 1.0
   44    46    51    52  -0.07550 -1.0 2.0
   44    46    51    52   0.20000  1.0 3.0
   44    46    51    67   0.56750  1.0 1.0
   44    46    51    67  -0.07550 -1.0 2.0
   44    46    51    67   0.20000  1.0 3.0
   44    46    51    55   0.56750  1.0 1.0
   44    46    51    55  -0.07550 -1.0 2.0
   44    46    51    55   0.20000  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    51   0.15000  1.0 3.0
   45    44    49    39   0.15000  1.0 3.0
   45    44    49    72   0.15000  1.0 3.0
   45    44    49    50   0.15000  1.0 3.0
   46    44    49    39   0.56750  1.0 1.0
   46    44    49    39  -0.07550 -1.0 2.0
   46    44    49    39   0.20000  1.0 3.0
   46    44    49    72   0.56750  1.0 1.0
   46    44    49    72  -0.07550 -1.0 2.0
   46    44    49    72   0.20000  1.0 3.0
   46    44    49    50   0.15000  1.0 3.0
   46    51    52    53   0.15000  1.0 3.0
   46    51    52    54   0.15000  1.0 3.0
   46    51    52    59   0.56750  1.0 1.0
   46    51    52    59  -0.07550 -1.0 2.0
   46    51    52    59   0.20000  1.0 3.0
   46    51    67    66   0.34400  1.0 1.0
   46    51    67    66   0.09450 -1.0 2.0
   46    51    67    66   0.11100  1.0 3.0
   46    51    67    68   0.15000  1.0 3.0
   46    51   -67    72   0.56750  1.0 1.0
   46    51   -67    72  -0.07550 -1.0 2.0
   46    51   -67    72   0.20000  1.0 3.0
   46    51    55    56   0.15000  1.0 3.0
   46    51    55    57   0.15000  1.0 3.0
   46    51    55    58   0.15000  1.0 3.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    67   0.15000  1.0 3.0
   47    46    51    55   0.15000  1.0 3.0
   48    46    51    52   0.15000  1.0 3.0
   48    46    51    67   0.15000  1.0 3.0
   48    46    51    55   0.15000  1.0 3.0
   51    52    59    60   0.15000  1.0 3.0
   51    52    59    61   0.56750  1.0 1.0
   51    52    59    61  -0.07550 -1.0 2.0
   51    52    59    61   0.20000  1.0 3.0
   51    52    59    64   0.86500  1.0 1.0
   51    52    59    64  -0.17500 -1.0 2.0
   51    52    59    64   0.20800  1.0 3.0
   51    67    72    73   0.15000  1.0 3.0
   51    67    72    74   0.15000  1.0 3.0
   51    67    72    49   0.56750  1.0 1.0
   51    67    72    49  -0.07550 -1.0 2.0
   51    67    72    49   0.20000  1.0 3.0
   52    51    67    66   0.34400  1.0 1.0
   52    51    67    66   0.09450 -1.0 2.0
   52    51    67    66   0.11100  1.0 3.0
   52    51    67    68   0.15000  1.0 3.0
   52    51    67    72   0.56750  1.0 1.0
   52    51    67    72  -0.07550 -1.0 2.0
   52    51    67    72   0.20000  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    57   0.15000  1.0 3.0
   52    51    55    58   0.15000  1.0 3.0
   52    59    61    62   0.15000  1.0 3.0
   52    59    61    63   0.15000  1.0 3.0
   52    59   -61    66   0.34400  1.0 1.0
   52    59   -61    66   0.09450 -1.0 2.0
   52    59   -61    66   0.11100  1.0 3.0
   52    59    64    65  -0.11600  1.0 1.0
   52    59    64    65  -0.09450 -1.0 2.0
   52    59    64    65   0.21250  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    61   0.15000  1.0 3.0
   53    52    59    64   0.23400  1.0 3.0
   54    52    59    60   0.15000  1.0 3.0
   54    52    59    61   0.15000  1.0 3.0
   54    52    59    64   0.23400  1.0 3.0
   59    61    66    67   0.46850  1.0 1.0
   59    61    66    67   0.08550 -1.0 2.0
   59    61    66    67   0.09800  1.0 3.0
   59    61    66    69   0.09850  1.0 1.0
   59    61    66    69   0.15250 -1.0 2.0
   59    61    66    69  -0.50650  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    66   0.15000  1.0 3.0
   60    59    64    65   0.19450  1.0 3.0
   61    59    64    65  -0.11600  1.0 1.0
   61    59    64    65  -0.09450 -1.0 2.0
   61    59    64    65   0.21250  1.0 3.0
   61    66   -67    51   0.46850  1.0 1.0
   61    66   -67    51   0.08550 -1.0 2.0
   61    66   -67    51   0.09800  1.0 3.0
   61    66    67    68   0.34800  1.0 3.0
   61    66    67    72   0.46850  1.0 1.0
   61    66    67    72   0.08550 -1.0 2.0
   61    66    67    72   0.09800  1.0 3.0
   61    66    69    70   7.00000 -1.0 2.0
   61    66    69    71   7.00000 -1.0 2.0
   62    61    66    67   0.34800  1.0 3.0
   62    61    66    69   0.00000  1.0 1.0
   63    61    66    67   0.34800  1.0 3.0
   63    61    66    69   0.00000  1.0 1.0
   66    67    72    73   0.15000  1.0 3.0
   66    67    72    74   0.15000  1.0 3.0
   66    67    72    49   0.34400  1.0 1.0
   66    67    72    49   0.09450 -1.0 2.0
   66    67    72    49   0.11100  1.0 3.0
   67    51    52    53   0.15000  1.0 3.0
   67    51    52    54   0.15000  1.0 3.0
   67    51   -52    59   0.56750  1.0 1.0
   67    51   -52    59  -0.07550 -1.0 2.0
   67    51   -52    59   0.20000  1.0 3.0
   67    51    55    56   0.15000  1.0 3.0
   67    51    55    57   0.15000  1.0 3.0
   67    51    55    58   0.15000  1.0 3.0
   67    66    69    70   7.00000 -1.0 2.0
   67    66    69    71   7.00000 -1.0 2.0
   67    72    49    39   0.56750  1.0 1.0
   67    72    49    39  -0.07550 -1.0 2.0
   67    72    49    39   0.20000  1.0 3.0
   67    72   -49    44   0.56750  1.0 1.0
   67    72   -49    44  -0.07550 -1.0 2.0
   67    72   -49    44   0.20000  1.0 3.0
   67    72    49    50   0.15000  1.0 3.0
   68    67    72    73   0.15000  1.0 3.0
   68    67    72    74   0.15000  1.0 3.0
   68    67    72    49   0.15000  1.0 3.0
   73    72    49    39   0.15000  1.0 3.0
   73    72    49    44   0.15000  1.0 3.0
   73    72    49    50   0.15000  1.0 3.0
   74    72    49    39   0.15000  1.0 3.0
   74    72    49    44   0.15000  1.0 3.0
   74    72    49    50   0.15000  1.0 3.0
   49    39    41    42   0.30150 -1.0 2.0
   49    39   -41    43   0.36750  1.0 3.0
   49    44    46    47   0.15000  1.0 3.0
   49    44    46    48   0.15000  1.0 3.0
   49    44   -46    51   0.56750  1.0 1.0
   49    44   -46    51  -0.07550 -1.0 2.0
   49    44   -46    51   0.20000  1.0 3.0
   69    66    67    51   0.09850  1.0 1.0
   69    66    67    51   0.15250 -1.0 2.0
   69    66    67    51  -0.50650  1.0 3.0
   69    66    67    68   0.00000  1.0 1.0
   69    66    67    72   0.09850  1.0 1.0
   69    66    67    72   0.15250 -1.0 2.0
   69    66    67    72  -0.50650  1.0 3.0
   64    59    61    62   0.23400  1.0 3.0
   64    59    61    63   0.23400  1.0 3.0
   64    59    61    66   1.05650  1.0 1.0
   64    59    61    66   0.15600 -1.0 2.0
   64    59    61    66   0.53150  1.0 3.0
   55    51    52    53   0.15000  1.0 3.0
   55    51    52    54   0.15000  1.0 3.0
   55    51    52    59   0.56750  1.0 1.0
   55    51    52    59  -0.07550 -1.0 2.0
   55    51    52    59   0.20000  1.0 3.0
   55    51    67    66   0.34400  1.0 1.0
   55    51    67    66   0.09450 -1.0 2.0
   55    51    67    66   0.11100  1.0 3.0
   55    51    67    68   0.15000  1.0 3.0
   55    51    67    72   0.56750  1.0 1.0
   55    51    67    72  -0.07550 -1.0 2.0
   55    51    67    72   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   61    67    66    69   1.10000 -1.0 2.0
   70    71    69    66   1.10000 -1.0 2.0
END
