* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    135    217     403
    1     0 S   NP   _N1_     1    28.82798    95.13188   -22.26123
    2     1 S   H    _HN1     2     1.02781    97.63387   -95.64948
    3     1 S   H    _H1_     3     1.02951    81.50656    11.88987
    4     1 S   H    _H2_     4     1.02829    32.82407   153.00063
    5     1 S   CT   _CA1     5     1.50118   140.93275   123.93854
    6     5 S   HC   _HA1     6     1.09567   105.21257    75.59159
    7     5 S   CO3  _C1_     7     1.53800   112.45805   -44.68701
    8     7 S   O2Z  _O11     8     1.26376   114.99226   -41.20352
    9     7 S   O2Z  _O12     9     1.26236   114.98814   137.98545
   10     5 S   CT   _CB1    10     1.53090   107.43136  -166.33026
   11    10 S   HC   HB11    11     1.09827   109.46925   -48.84311
   12    10 S   HC   HB12    12     1.09817   110.39074    67.80345
   13    10 S   CT   _CG1    13     1.52974   112.59927  -169.81740
   14    13 S   HC   HG11    14     1.09594   110.54753   -64.02351
   15    13 S   HC   HG12    15     1.09660   109.87878    55.21174
   16    13 S   C    _CD1    16     1.51807   112.30736   175.72584
   17    16 S   O    _OE1    17     1.22718   123.31614     3.59831
   18    16 S   N    _N2_    18     1.38613   111.56695  -176.72165
   19    18 S   H    _HN2    19     1.01578   118.94252     2.55328
   20    18 S   CT1  _CA2    20     1.46313   123.52936  -179.24723
   21    20 S   HC   _HA2    21     1.09728   109.41315    -2.07924
   22    20 S   C    _C2_    22     1.53407   108.66161  -117.77936
   23    22 S   O    _O2_    23     1.23044   122.32134  -148.39567
   24    20 S   CT   _CB2    32     1.53332   111.06797   119.84771
   25    24 S   HC   HB21    33     1.09584   109.57626    56.60786
   26    24 S   HC   HB22    34     1.09494   110.97738   175.42825
   27    22 S   N    _N3_    24     1.38347   113.59596    39.08994
   28    27 S   H    _HN3    25     1.01616   119.51346    -3.53541
   29    24 S   S    _SG2    35     1.82607   111.07992   -64.83439
   30    27 S   CT   _CA3    26     1.45288   123.16971   177.00487
   31    30 S   HC   HA31    27     1.09551   107.51235   -64.23108
   32    30 S   HC   HA32    28     1.09557   107.96813    52.18690
   33    29 S   CT   _C18    36     1.81983    99.18847   149.81886
   34    33 S   HC   _H3_    37     1.09525   110.27491   -47.03012
   35    33 S   HC   _H4_    38     1.09489   108.33962    69.80039
   36    30 S   CO3  _C3_    29     1.52946   114.11928   174.17409
   37    36 S   O2Z  _O31    30     1.26371   116.06056    -0.99130
   38    36 S   O2Z  _O32    31     1.26429   114.41270   179.07656
   39    33 S   CM   _C4_    39     1.50029   110.34625  -167.84505
   40    39 S   CMA  _C5_    40     1.35058   126.93915   -96.28981
   41    40 S   OM   _O16    41     1.26303   128.09620     3.11112
   42    40 S   OS   _O17    42     1.41905   109.55948  -174.91704
   43    42 S   CT   _C17    43     1.44325   106.23944   -16.76448
   44    43 S   HC   _H34    44     1.10025   106.77195   -89.82635
   45    39 S   CT   _C13    45     1.50235   121.68715    91.34253
   46    45 S   HC   _H30    46     1.09816   107.57633    75.26202
   47    43 S   CT   _C15    62     1.53835   108.61003   151.45467
   48    47 S   HC   _H32    63     1.10095   108.28102   -40.67962
   49    45 S   CT   _C11    47     1.53410   116.04509   -48.18316
   50    49 S   HC   _H26    48     1.09664   109.67369    54.28580
   51    49 S   HC   _H27    49     1.09800   110.32434   -62.48203
   52    49 S   CT   _C10    50     1.52965   114.19441   173.95785
   53    52 S   HC   _H24    51     1.09774   109.39794   -66.98227
   54    52 S   HC   _H25    52     1.09758   107.82171   179.28181
   55    52 S   CM   _C6_    53     1.51349   114.82736    55.89348
   56    55 S   CT   _C14    54     1.52267   114.94149   -74.62766
   57    56 S   HC   _H31    55     1.09925   106.47775   -35.48809
   58    55 S   CM   _C8_    69     1.34312   119.55445   109.01576
   59    58 S   HC   _H20    70     1.08193   122.84168   177.89643
   60    58 S   HC   _H21    71     1.08608   121.03563    -2.20992
   61    56 S   CT   _C12    56     1.53770   117.11053  -154.09654
   62    61 S   HC   _H28    57     1.09549   113.35263    33.00121
   63    61 S   HC   _H29    58     1.09899   109.59473   151.19438
   64    61 S   CT   _C16    59     1.52488   105.98510   -90.02056
   65    64 S   HC   _H33    60     1.09458   111.72543    94.61090
   66    64 S   CM   _C7_    61     1.50508   104.20963   -24.80602
   67    64 S   OH   _O18    67     1.41845   110.30316  -143.97359
   68    67 S   HO   _H37    68     0.97217   107.34064   -59.93697
   69    66 S   CM   _C9_    64     1.34052   122.62726  -179.34988
   70    69 S   HC   _H22    65     1.08527   120.78256     1.41720
   71    69 S   HC   _H23    66     1.08350   122.17307  -179.06080
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  16   7  12   5  17   7
   8   5   4   9   4   3  10  12   6   3   1   1   8   5   4   7
   4   5   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    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    45  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    45    46    49  
   35    39    40    45  
   39    40    45  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    49    50    51    52    47  
   41    42    43    44    45    46    49    47  
   42    43    45  
   43    44    45    46    49    56    66    47    48  
   44    45    46    49    50    51    52    55    56    57    61    64    66    47    48    69  
   45    46    49    56    66    47    48  
   46    49    50    51    52    53    54    55    56    66    47    48  
   49    50    51    52    47  
   48    69    70    71    67    58    49    52    55    56    57    61    62    63    64    65    66  
   69    55    56    57    61    64    66  
   50    51    52    53    54    55    56    58  
   51    52    53    54    55  
   52    53    54    55  
   53    54    55    56    57    61    58    59    60  
   54    55    56    58  
   55    56    58  
   56    57    61    62    63    64    66    58    59    60  
   57    61    62    63    64    65    66    69    67    58    59    60  
   61    62    63    64    66    58  
   59    60    61  
   60  
    0  
   62    63    64    65    66    69    67    68  
   63    64    65    66    67  
   64    65    66    67  
   65    66    69    70    71    67    68  
   66    69    67    68  
   69    70    71    67    68  
   68    69  
    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   0.047500   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   2.4200   0.0300   0.115000   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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
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   317.000  1.510
   39    40   465.000  1.376
   39    45   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    47   268.000  1.529
   45    46   340.000  1.090
   45    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   317.000  1.510
   55    56   317.000  1.510
   55    58   549.000  1.340
   56    57   340.000  1.090
   56    61   268.000  1.529
   56    47   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   340.000  1.090
   64    66   317.000  1.510
   64    67   320.000  1.410
   66    47   317.000  1.510
   66    69   549.000  1.340
   47    48   340.000  1.090
   69    70   340.000  1.080
   69    71   340.000  1.080
   67    68   553.000  0.945
   58    59   340.000  1.080
   58    60   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  112.20000
   33    39    40    70.00000  124.00000
   33    39    45    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    45    43    70.00000  112.02700
   39    45    46    35.00000  109.50000
   39    45    49    70.00000  112.02700
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    47    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    49    58.35000  112.70000
   43    47    56    58.35000  112.70000
   43    47    66    70.00000  112.02700
   43    47    48    37.50000  110.70000
   45    39    40    70.00000  124.00000
   45    43    44    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    52    58.35000  112.70000
   49    45    46    37.50000  110.70000
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    55    70.00000  112.02700
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    55    56    65.00000  117.92700
   52    55    58    70.00000  124.00000
   54    52    53    33.00000  107.80000
   55    52    53    35.00000  109.50000
   55    52    54    35.00000  109.50000
   55    56    57    35.00000  109.50000
   55    56    61    70.00000  112.02700
   55    56    47    70.00000  112.02700
   55    58    59    35.00000  120.00000
   55    58    60    35.00000  120.00000
   56    61    62    37.50000  110.70000
   56    61    63    37.50000  110.70000
   56    61    64    58.35000  112.70000
   56    47    66    70.00000  112.02700
   56    47    48    37.50000  110.70000
   61    56    57    37.50000  110.70000
   61    64    65    37.50000  110.70000
   61    64    66    70.00000  112.02700
   61    64    67    50.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    66    47    65.00000  117.92700
   64    66    69    70.00000  124.00000
   64    67    68    55.00000  108.50000
   66    64    65    35.00000  109.50000
   66    47    48    35.00000  109.50000
   66    69    70    35.00000  120.00000
   66    69    71    35.00000  120.00000
   47    43    44    37.50000  110.70000
   47    43    45    58.35000  112.70000
   47    56    57    37.50000  110.70000
   47    56    61    58.35000  112.70000
   69    66    47    70.00000  124.00000
   71    69    70    35.00000  117.00000
   67    64    65    35.00000  109.50000
   67    64    66    90.00000  110.39200
   58    55    56    70.00000  124.00000
   60    58    59    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    45   0.30250  1.0 1.0
   29    33    39    45  -0.14950 -1.0 2.0
   29    33    39    45   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    45    43   0.46850  1.0 1.0
   33    39    45    43   0.08550 -1.0 2.0
   33    39    45    43   0.09800  1.0 3.0
   33    39    45    46   0.34800  1.0 3.0
   33    39    45    49   0.46850  1.0 1.0
   33    39    45    49   0.08550 -1.0 2.0
   33    39    45    49   0.09800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    45   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    45   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   39    45    49    50   0.15000  1.0 3.0
   39    45    49    51   0.15000  1.0 3.0
   39    45    49    52   0.34400  1.0 1.0
   39    45    49    52   0.09450 -1.0 2.0
   39    45    49    52   0.11100  1.0 3.0
   40    39   -45    43   0.09850  1.0 1.0
   40    39   -45    43   0.15250 -1.0 2.0
   40    39   -45    43  -0.50650  1.0 3.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    49   0.09850  1.0 1.0
   40    39    45    49   0.15250 -1.0 2.0
   40    39    45    49  -0.50650  1.0 3.0
   40    42    43    44   0.08050  1.0 3.0
   40    42   -43    45  -0.46850  1.0 1.0
   40    42   -43    45   0.09300 -1.0 2.0
   40    42   -43    45  -0.12850  1.0 3.0
   40    42    43    47  -0.46850  1.0 1.0
   40    42    43    47   0.09300 -1.0 2.0
   40    42    43    47  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43   -45    39   0.61850  1.0 1.0
   42    43   -45    39  -0.22750 -1.0 2.0
   42    43   -45    39   0.15300  1.0 3.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    49   0.62750  1.0 1.0
   42    43    45    49  -0.30950 -1.0 2.0
   42    43    45    49   0.27300  1.0 3.0
   42    43    47    56   0.62750  1.0 1.0
   42    43    47    56  -0.30950 -1.0 2.0
   42    43    47    56   0.27300  1.0 3.0
   42    43    47    66   0.61850  1.0 1.0
   42    43    47    66  -0.22750 -1.0 2.0
   42    43    47    66   0.15300  1.0 3.0
   42    43    47    48   0.23400  1.0 3.0
   43    45    49    50   0.15000  1.0 3.0
   43    45    49    51   0.15000  1.0 3.0
   43    45    49    52   0.56750  1.0 1.0
   43    45    49    52  -0.07550 -1.0 2.0
   43    45    49    52   0.20000  1.0 3.0
   44    43    45    39   0.15000  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    47    56   0.15000  1.0 3.0
   44    43    47    66   0.15000  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   45    39    40    41   7.00000 -1.0 2.0
   45    39   -40    42   7.00000 -1.0 2.0
   45    43    47    56   0.56750  1.0 1.0
   45    43    47    56  -0.07550 -1.0 2.0
   45    43    47    56   0.20000  1.0 3.0
   45    43    47    66   0.34400  1.0 1.0
   45    43    47    66   0.09450 -1.0 2.0
   45    43    47    66   0.11100  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    49    52    53   0.15000  1.0 3.0
   45    49    52    54   0.15000  1.0 3.0
   45    49    52    55   0.34400  1.0 1.0
   45    49    52    55   0.09450 -1.0 2.0
   45    49    52    55   0.11100  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    52   0.15000  1.0 3.0
   49    52    55    56   0.46850  1.0 1.0
   49    52    55    56   0.08550 -1.0 2.0
   49    52    55    56   0.09800  1.0 3.0
   49    52    55    58   0.09850  1.0 1.0
   49    52    55    58   0.15250 -1.0 2.0
   49    52    55    58  -0.50650  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    55   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54   0.15000  1.0 3.0
   51    49    52    55   0.15000  1.0 3.0
   52    55    56    57   0.34800  1.0 3.0
   52    55    56    61   0.46850  1.0 1.0
   52    55    56    61   0.08550 -1.0 2.0
   52    55    56    61   0.09800  1.0 3.0
   52    55    56    47   0.46850  1.0 1.0
   52    55    56    47   0.08550 -1.0 2.0
   52    55    56    47   0.09800  1.0 3.0
   52    55    58    59   7.00000 -1.0 2.0
   52    55    58    60   7.00000 -1.0 2.0
   53    52    55    56   0.34800  1.0 3.0
   53    52    55    58   0.00000  1.0 1.0
   54    52    55    56   0.34800  1.0 3.0
   54    52    55    58   0.00000  1.0 1.0
   55    56    61    62   0.15000  1.0 3.0
   55    56    61    63   0.15000  1.0 3.0
   55    56    61    64   0.34400  1.0 1.0
   55    56    61    64   0.09450 -1.0 2.0
   55    56    61    64   0.11100  1.0 3.0
   55    56    47    43   0.34400  1.0 1.0
   55    56    47    43   0.09450 -1.0 2.0
   55    56    47    43   0.11100  1.0 3.0
   55    56    47    66   0.31000  1.0 1.0
   55    56    47    66   0.14700 -1.0 2.0
   55    56    47    66   0.07550  1.0 3.0
   55    56    47    48   0.15000  1.0 3.0
   56    55    58    59   7.00000 -1.0 2.0
   56    55    58    60   7.00000 -1.0 2.0
   56    61    64    65   0.15000  1.0 3.0
   56    61   -64    66   0.34400  1.0 1.0
   56    61   -64    66   0.09450 -1.0 2.0
   56    61   -64    66   0.11100  1.0 3.0
   56    61    64    67   0.86500  1.0 1.0
   56    61    64    67  -0.17500 -1.0 2.0
   56    61    64    67   0.20800  1.0 3.0
   57    56    61    62   0.15000  1.0 3.0
   57    56    61    63   0.15000  1.0 3.0
   57    56    61    64   0.15000  1.0 3.0
   57    56    47    43   0.15000  1.0 3.0
   57    56    47    66   0.15000  1.0 3.0
   57    56    47    48   0.15000  1.0 3.0
   61    56    47    43   0.56750  1.0 1.0
   61    56    47    43  -0.07550 -1.0 2.0
   61    56    47    43   0.20000  1.0 3.0
   61    56   -47    66   0.34400  1.0 1.0
   61    56   -47    66   0.09450 -1.0 2.0
   61    56   -47    66   0.11100  1.0 3.0
   61    56    47    48   0.15000  1.0 3.0
   61    64   -66    47   0.46850  1.0 1.0
   61    64   -66    47   0.08550 -1.0 2.0
   61    64   -66    47   0.09800  1.0 3.0
   61    64    66    69   0.09850  1.0 1.0
   61    64    66    69   0.15250 -1.0 2.0
   61    64    66    69  -0.50650  1.0 3.0
   61    64    67    68  -0.11600  1.0 1.0
   61    64    67    68  -0.09450 -1.0 2.0
   61    64    67    68   0.21250  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    67   0.23400  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   63    61    64    67   0.23400  1.0 3.0
   64    66    47    43   0.46850  1.0 1.0
   64    66    47    43   0.08550 -1.0 2.0
   64    66    47    43   0.09800  1.0 3.0
   64    66   -47    56   0.46850  1.0 1.0
   64    66   -47    56   0.08550 -1.0 2.0
   64    66   -47    56   0.09800  1.0 3.0
   64    66    47    48   0.34800  1.0 3.0
   64    66    69    70   7.00000 -1.0 2.0
   64    66    69    71   7.00000 -1.0 2.0
   65    64    66    47   0.34800  1.0 3.0
   65    64    66    69   0.00000  1.0 1.0
   65    64    67    68   0.19450  1.0 3.0
   66    64    67    68  -0.07800  1.0 1.0
   66    64    67    68  -0.21500 -1.0 2.0
   66    64    67    68  -0.03150  1.0 3.0
   47    43    45    39   0.34400  1.0 1.0
   47    43    45    39   0.09450 -1.0 2.0
   47    43    45    39   0.11100  1.0 3.0
   47    43    45    46   0.15000  1.0 3.0
   47    43    45    49   0.56750  1.0 1.0
   47    43    45    49  -0.07550 -1.0 2.0
   47    43    45    49   0.20000  1.0 3.0
   47    56    61    62   0.15000  1.0 3.0
   47    56    61    63   0.15000  1.0 3.0
   47    56   -61    64   0.56750  1.0 1.0
   47    56   -61    64  -0.07550 -1.0 2.0
   47    56   -61    64   0.20000  1.0 3.0
   47    66    69    70   7.00000 -1.0 2.0
   47    66    69    71   7.00000 -1.0 2.0
   69    66    47    43   0.09850  1.0 1.0
   69    66    47    43   0.15250 -1.0 2.0
   69    66    47    43  -0.50650  1.0 3.0
   69    66    47    56   0.09850  1.0 1.0
   69    66    47    56   0.15250 -1.0 2.0
   69    66    47    56  -0.50650  1.0 3.0
   69    66    47    48   0.00000  1.0 1.0
   67    64    66    47   0.18000  1.0 1.0
   67    64    66    47   0.16450 -1.0 2.0
   67    64    66    47   0.04450  1.0 3.0
   67    64    66    69   0.67800  1.0 1.0
   67    64    66    69   0.47050 -1.0 2.0
   67    64    66    69  -0.62500  1.0 3.0
   58    55    56    57   0.00000  1.0 1.0
   58    55    56    61   0.09850  1.0 1.0
   58    55    56    61   0.15250 -1.0 2.0
   58    55    56    61  -0.50650  1.0 3.0
   58    55    56    47   0.09850  1.0 1.0
   58    55    56    47   0.15250 -1.0 2.0
   58    55    56    47  -0.50650  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
   38    30    36    37  10.50000 -1.0 2.0
   33    45    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   52    56    55    58   1.10000 -1.0 2.0
   64    47    66    69   1.10000 -1.0 2.0
   70    71    69    66   1.10000 -1.0 2.0
   59    60    58    55   1.10000 -1.0 2.0
END
