* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    139    218     415
    1     0 S   NP   _N1_     1    28.00562    95.20408   -23.72111
    2     1 S   H    _HN1     2     1.02835    25.77772   151.00691
    3     1 S   H    _H1_     3     1.02776   103.24885  -105.20306
    4     1 S   H    _H2_     4     1.02957    85.14274     2.51933
    5     1 S   CT   _CA1     5     1.50125   133.03785   116.03351
    6     5 S   HC   _HA1     6     1.09574   105.22344    74.63018
    7     5 S   CO3  _C1_     7     1.53794   112.37536   -45.57805
    8     7 S   O2Z  _O11     8     1.26365   114.99772   -43.69057
    9     7 S   O2Z  _O12     9     1.26237   114.93585   135.44680
   10     5 S   CT   _CB1    10     1.53099   107.42600  -167.44292
   11    10 S   HC   HB11    11     1.09825   109.35723   -50.47363
   12    10 S   HC   HB12    12     1.09816   110.41587    66.09304
   13    10 S   CT   _CG1    13     1.53007   112.65383  -171.54660
   14    13 S   HC   HG11    14     1.09597   110.47709   -63.94816
   15    13 S   HC   HG12    15     1.09655   109.93413    55.24614
   16    13 S   C    _CD1    16     1.51834   112.34487   175.63341
   17    16 S   O    _OE1    17     1.22742   123.30462    -0.47395
   18    16 S   N    _N2_    18     1.38540   111.66306   179.46295
   19    18 S   H    _HN2    19     1.01561   119.01037     4.79216
   20    18 S   CT1  _CA2    20     1.45887   122.98152   178.18253
   21    20 S   HC   _HA2    21     1.09719   109.02079    22.18339
   22    20 S   C    _C2_    22     1.52866   106.76257   -95.00424
   23    22 S   O    _O2_    23     1.22998   122.92642   -29.58663
   24    20 S   CT   _CB2    32     1.53328   112.04384   145.37852
   25    24 S   HC   HB21    33     1.09332   109.48926    55.08916
   26    24 S   HC   HB22    34     1.09482   109.68164   173.73603
   27    22 S   N    _N3_    24     1.38469   112.67456   153.10056
   28    27 S   H    _HN3    25     1.01658   120.40479    -1.51672
   29    24 S   S    _SG2    35     1.83045   110.38930   -66.70830
   30    27 S   CT   _CA3    26     1.45358   122.39660   178.68136
   31    30 S   HC   HA31    27     1.09567   107.56186   -61.10534
   32    30 S   HC   HA32    28     1.09569   107.83163    55.19272
   33    29 S   CT   _C9_    36     1.88951   103.42145   167.60072
   34    30 S   CO3  _C3_    29     1.52876   114.42057   177.11894
   35    34 S   O2Z  _O31    30     1.26321   116.10046    -1.51904
   36    34 S   O2Z  _O32    31     1.26453   114.38960   178.55355
   37    33 S   CM   _C8_    37     1.51878   107.50801    47.31000
   38    37 S   HC   _H10    38     1.09120   115.61596   -74.20454
   39    33 S   CT   _C14    55     1.55514   105.14658   -70.41870
   40    39 S   HC   _H15    56     1.09642   111.23937    65.55557
   41    39 S   HC   _H16    57     1.09835   110.39797   -51.84473
   42    37 S   CMA  _C7_    39     1.34945   127.75179   107.25440
   43    42 S   OM   _O33    40     1.26243   128.95242   178.85022
   44    42 S   CT   _C6_    41     1.52414   120.00017    -0.51396
   45    44 S   HC   _H8_    42     1.10029   108.53657   110.26844
   46    44 S   HC   _H9_    43     1.10104   110.32542  -135.25185
   47    44 S   CT   _C5_    44     1.54852   115.87648   -11.72733
   48    47 S   HC   _H3_    45     1.10036   106.64214   156.05138
   49    33 S   CT   _C10    46     1.58720   111.90532   169.31817
   50    47 S   CT   _C4_    70     1.53705   108.79608   -91.54785
   51    50 S   HC   _H5_    71     1.09228   112.57607    55.07427
   52    50 S   HC   _H6_    72     1.09705   109.62002   -63.02707
   53    50 S   HC   _H7_    73     1.09211   112.56530   179.03754
   54    49 S   CT   _C11    47     1.57943   110.22484   163.94855
   55    54 S   HC   _H11    48     1.09807   108.51060  -175.15063
   56    54 S   HC   _H12    49     1.09601   110.57307    69.86250
   57    49 S   CT   _C18    66     1.55467   112.97225    45.64838
   58    57 S   HC   _H22    67     1.09236   113.35451   -64.22528
   59    57 S   HC   _H23    68     1.09652   110.64134   176.17423
   60    57 S   HC   _H24    69     1.09371   112.19144    56.42299
   61    54 S   CT   _C12    50     1.53795   115.13678   -51.62268
   62    61 S   HC   _H4_    51     1.09747   109.35428   -59.80005
   63    61 S   CT   _C13    52     1.53231   108.59588    56.49575
   64    63 S   HC   _H13    53     1.09732   109.88659  -178.39624
   65    63 S   HC   _H14    54     1.09677   111.11887    63.57803
   66    61 S   CM   _C15    58     1.52853   110.83919  -176.34559
   67    66 S   CM   _C16    59     1.34366   124.76444  -104.06502
   68    67 S   HC   _H17    60     1.08561   121.18418  -179.34538
   69    67 S   HC   _H18    61     1.08343   122.56520     1.24553
   70    66 S   CT   _C17    62     1.50790   115.53565    77.29947
   71    70 S   HC   _H19    63     1.09395   110.82001   -63.69769
   72    70 S   HC   _H20    64     1.09494   110.28508    56.56820
   73    70 S   HC   _H21    65     1.09542   112.20239   176.23225
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  23   2   1   1  14   5  13   6   5   8   4  11   5   4  14   7
  15   5   2   1   1  14   6   5   4   2   1   1  12   6   5   2
   1   7   6   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    47    49    54    63    39    40    41    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    47    48    49    54    55    56    61    63    64    65    39    40    41    57    58    59    60    50  
   35    36  
   36  
    0  
   38    42    43    44    45    46    47    49    54    63    39    40    41    57  
   42    43    44    49    39  
   40    41    66    57    42    47    49    54    61    62    63    64    65  
   41    49    61    63    64    65  
   49    61    63    64    65  
   43    44    45    46    47    48    49    50  
   44    45    46    47  
   45    46    47    48    49    54    57    50    51    52    53  
   46    47    48    49    50  
   47    48    49    50  
   48    49    54    55    56    61    57    58    59    60    50    51    52    53  
   49    54    57    50    51    52    53  
   54    55    56    61    62    63    66    57    58    59    60    50    51    52    53  
   51    52    53    54    57  
   52    53  
   53  
    0  
   55    56    61    62    63    64    65    66    67    70    57    58    59    60  
   56    61    62    63    66    57  
   61    62    63    66    57  
   58    59    60    61  
   59    60  
   60  
    0  
   62    63    64    65    66    67    68    69    70    71    72    73  
   63    64    65    66    67    70  
   64    65    66    67    70  
   65    66  
   66  
   67    68    69    70    71    72    73  
   68    69    70    71    72    73  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    42   465.000  1.376
   42    43   745.000  1.250
   42    44   270.000  1.512
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   268.000  1.529
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    50   268.000  1.529
   49    54   268.000  1.529
   49    57   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   268.000  1.529
   61    66   317.000  1.510
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   66    67   549.000  1.340
   66    70   317.000  1.510
   67    68   340.000  1.080
   67    69   340.000  1.080
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    42    70.00000  124.00000
   33    49    47    58.35000  112.70000
   33    49    54    58.35000  112.70000
   33    49    57    58.35000  112.70000
   33    39    63    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43    65.00000  137.10300
   37    42    44    65.00000  122.18000
   42    37    38    40.00000  120.50800
   42    44    45    45.00000  110.52000
   42    44    46    45.00000  110.52000
   42    44    47    70.00000  112.02700
   44    42    43    85.00000  112.85300
   44    47    48    37.50000  110.70000
   44    47    49    58.35000  112.70000
   44    47    50    58.35000  112.70000
   46    44    45    33.00000  107.80000
   47    44    45    37.50000  110.70000
   47    44    46    37.50000  110.70000
   47    49    54    58.35000  112.70000
   47    49    57    58.35000  112.70000
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   47    50    53    37.50000  110.70000
   49    33    37    70.00000  112.02700
   49    47    48    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    61    58.35000  112.70000
   49    57    58    37.50000  110.70000
   49    57    59    37.50000  110.70000
   49    57    60    37.50000  110.70000
   54    61    62    37.50000  110.70000
   54    61    63    58.35000  112.70000
   54    61    66    70.00000  112.02700
   56    54    55    33.00000  107.80000
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   61    63    64    37.50000  110.70000
   61    63    65    37.50000  110.70000
   61    63    39    58.35000  112.70000
   61    66    67    70.00000  124.00000
   61    66    70    65.00000  117.92700
   63    61    62    37.50000  110.70000
   63    39    40    37.50000  110.70000
   63    39    41    37.50000  110.70000
   65    63    64    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    33    49    58.35000  112.70000
   39    63    64    37.50000  110.70000
   39    63    65    37.50000  110.70000
   41    39    40    33.00000  107.80000
   66    61    62    35.00000  109.50000
   66    61    63    70.00000  112.02700
   66    67    68    35.00000  120.00000
   66    67    69    35.00000  120.00000
   66    70    71    35.00000  109.50000
   66    70    72    35.00000  109.50000
   66    70    73    35.00000  109.50000
   69    67    68    35.00000  117.00000
   70    66    67    70.00000  124.00000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   57    49    54    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   50    47    48    37.50000  110.70000
   50    47    49    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   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    37    38   0.00000  1.0 1.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    49    47   0.44750  1.0 1.0
   29    33    49    47  -0.17800 -1.0 2.0
   29    33    49    47   0.20200  1.0 3.0
   29    33    49    54   0.44750  1.0 1.0
   29    33    49    54  -0.17800 -1.0 2.0
   29    33    49    54   0.20200  1.0 3.0
   29    33    49    57   0.44750  1.0 1.0
   29    33    49    57  -0.17800 -1.0 2.0
   29    33    49    57   0.20200  1.0 3.0
   29    33    39    63   0.44750  1.0 1.0
   29    33    39    63  -0.17800 -1.0 2.0
   29    33    39    63   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    44   7.00000 -1.0 2.0
   33    49    54    55   0.15000  1.0 3.0
   33    49    54    56   0.15000  1.0 3.0
   33    49    54    61   0.56750  1.0 1.0
   33    49    54    61  -0.07550 -1.0 2.0
   33    49    54    61   0.20000  1.0 3.0
   33    49    57    58   0.15000  1.0 3.0
   33    49    57    59   0.15000  1.0 3.0
   33    49    57    60   0.15000  1.0 3.0
   37    33    49    47   0.34400  1.0 1.0
   37    33    49    47   0.09450 -1.0 2.0
   37    33    49    47   0.11100  1.0 3.0
   37    33    49    54   0.34400  1.0 1.0
   37    33    49    54   0.09450 -1.0 2.0
   37    33    49    54   0.11100  1.0 3.0
   37    33    49    57   0.34400  1.0 1.0
   37    33    49    57   0.09450 -1.0 2.0
   37    33    49    57   0.11100  1.0 3.0
   37    33    39    63   0.34400  1.0 1.0
   37    33    39    63   0.09450 -1.0 2.0
   37    33    39    63   0.11100  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    42    44    45   0.00000  1.0 1.0
   37    42    44    46   0.00000  1.0 1.0
   37    42   -44    47   0.09850  1.0 1.0
   37    42   -44    47   0.15250 -1.0 2.0
   37    42   -44    47  -0.50650  1.0 3.0
   38    37    42    43   7.00000 -1.0 2.0
   38    37    42    44   7.00000 -1.0 2.0
   42    44    47    48   0.15000  1.0 3.0
   42    44    47    49   0.34400  1.0 1.0
   42    44    47    49   0.09450 -1.0 2.0
   42    44    47    49   0.11100  1.0 3.0
   42    44    47    50   0.34400  1.0 1.0
   42    44    47    50   0.09450 -1.0 2.0
   42    44    47    50   0.11100  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.00000  1.0 1.0
   43    42    44    47   0.09700  1.0 1.0
   43    42    44    47   0.15600 -1.0 2.0
   43    42    44    47  -0.50800  1.0 3.0
   44    47   -49    33   0.56750  1.0 1.0
   44    47   -49    33  -0.07550 -1.0 2.0
   44    47   -49    33   0.20000  1.0 3.0
   44    47    49    54   0.56750  1.0 1.0
   44    47    49    54  -0.07550 -1.0 2.0
   44    47    49    54   0.20000  1.0 3.0
   44    47    49    57   0.56750  1.0 1.0
   44    47    49    57  -0.07550 -1.0 2.0
   44    47    49    57   0.20000  1.0 3.0
   44    47    50    51   0.15000  1.0 3.0
   44    47    50    52   0.15000  1.0 3.0
   44    47    50    53   0.15000  1.0 3.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    49   0.15000  1.0 3.0
   45    44    47    50   0.15000  1.0 3.0
   46    44    47    48   0.15000  1.0 3.0
   46    44    47    49   0.15000  1.0 3.0
   46    44    47    50   0.15000  1.0 3.0
   47    49    54    55   0.15000  1.0 3.0
   47    49    54    56   0.15000  1.0 3.0
   47    49    54    61   0.56750  1.0 1.0
   47    49    54    61  -0.07550 -1.0 2.0
   47    49    54    61   0.20000  1.0 3.0
   47    49    57    58   0.15000  1.0 3.0
   47    49    57    59   0.15000  1.0 3.0
   47    49    57    60   0.15000  1.0 3.0
   48    47    49    33   0.15000  1.0 3.0
   48    47    49    54   0.15000  1.0 3.0
   48    47    49    57   0.15000  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   48    47    50    53   0.15000  1.0 3.0
   49    33    37    38   0.00000  1.0 1.0
   49    33   -37    42   0.09850  1.0 1.0
   49    33   -37    42   0.15250 -1.0 2.0
   49    33   -37    42  -0.50650  1.0 3.0
   49    33    39    63   0.56750  1.0 1.0
   49    33    39    63  -0.07550 -1.0 2.0
   49    33    39    63   0.20000  1.0 3.0
   49    33    39    40   0.15000  1.0 3.0
   49    33    39    41   0.15000  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    52   0.15000  1.0 3.0
   49    47    50    53   0.15000  1.0 3.0
   49    54    61    62   0.15000  1.0 3.0
   49    54   -61    63   0.56750  1.0 1.0
   49    54   -61    63  -0.07550 -1.0 2.0
   49    54   -61    63   0.20000  1.0 3.0
   49    54    61    66   0.34400  1.0 1.0
   49    54    61    66   0.09450 -1.0 2.0
   49    54    61    66   0.11100  1.0 3.0
   54    49    57    58   0.15000  1.0 3.0
   54    49    57    59   0.15000  1.0 3.0
   54    49    57    60   0.15000  1.0 3.0
   54    61    63    64   0.15000  1.0 3.0
   54    61    63    65   0.15000  1.0 3.0
   54    61    63    39   0.56750  1.0 1.0
   54    61    63    39  -0.07550 -1.0 2.0
   54    61    63    39   0.20000  1.0 3.0
   54    61    66    67   0.09850  1.0 1.0
   54    61    66    67   0.15250 -1.0 2.0
   54    61    66    67  -0.50650  1.0 3.0
   54    61    66    70   0.46850  1.0 1.0
   54    61    66    70   0.08550 -1.0 2.0
   54    61    66    70   0.09800  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    66   0.15000  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   56    54    61    66   0.15000  1.0 3.0
   61    63   -39    33   0.56750  1.0 1.0
   61    63   -39    33  -0.07550 -1.0 2.0
   61    63   -39    33   0.20000  1.0 3.0
   61    63    39    40   0.15000  1.0 3.0
   61    63    39    41   0.15000  1.0 3.0
   61    66    67    68   7.00000 -1.0 2.0
   61    66    67    69   7.00000 -1.0 2.0
   61    66    70    71   0.34800  1.0 3.0
   61    66    70    72   0.34800  1.0 3.0
   61    66    70    73   0.34800  1.0 3.0
   62    61    63    64   0.15000  1.0 3.0
   62    61    63    65   0.15000  1.0 3.0
   62    61    63    39   0.15000  1.0 3.0
   62    61    66    67   0.00000  1.0 1.0
   62    61    66    70   0.34800  1.0 3.0
   63    61    66    67   0.09850  1.0 1.0
   63    61    66    67   0.15250 -1.0 2.0
   63    61    66    67  -0.50650  1.0 3.0
   63    61    66    70   0.46850  1.0 1.0
   63    61    66    70   0.08550 -1.0 2.0
   63    61    66    70   0.09800  1.0 3.0
   64    63    39    33   0.15000  1.0 3.0
   64    63    39    40   0.15000  1.0 3.0
   64    63    39    41   0.15000  1.0 3.0
   65    63    39    33   0.15000  1.0 3.0
   65    63    39    40   0.15000  1.0 3.0
   65    63    39    41   0.15000  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    42   0.09850  1.0 1.0
   39    33    37    42   0.15250 -1.0 2.0
   39    33    37    42  -0.50650  1.0 3.0
   39    33    49    47   0.56750  1.0 1.0
   39    33    49    47  -0.07550 -1.0 2.0
   39    33    49    47   0.20000  1.0 3.0
   39    33   -49    54   0.56750  1.0 1.0
   39    33   -49    54  -0.07550 -1.0 2.0
   39    33   -49    54   0.20000  1.0 3.0
   39    33    49    57   0.56750  1.0 1.0
   39    33    49    57  -0.07550 -1.0 2.0
   39    33    49    57   0.20000  1.0 3.0
   66    61    63    64   0.15000  1.0 3.0
   66    61    63    65   0.15000  1.0 3.0
   66    61    63    39   0.34400  1.0 1.0
   66    61    63    39   0.09450 -1.0 2.0
   66    61    63    39   0.11100  1.0 3.0
   67    66    70    71   0.00000  1.0 1.0
   67    66    70    72   0.00000  1.0 1.0
   67    66    70    73   0.00000  1.0 1.0
   70    66    67    68   7.00000 -1.0 2.0
   70    66    67    69   7.00000 -1.0 2.0
   57    49    54    55   0.15000  1.0 3.0
   57    49    54    56   0.15000  1.0 3.0
   57    49    54    61   0.56750  1.0 1.0
   57    49    54    61  -0.07550 -1.0 2.0
   57    49    54    61   0.20000  1.0 3.0
   50    47    49    33   0.56750  1.0 1.0
   50    47    49    33  -0.07550 -1.0 2.0
   50    47    49    33   0.20000  1.0 3.0
   50    47    49    54   0.56750  1.0 1.0
   50    47    49    54  -0.07550 -1.0 2.0
   50    47    49    54   0.20000  1.0 3.0
   50    47    49    57   0.56750  1.0 1.0
   50    47    49    57  -0.07550 -1.0 2.0
   50    47    49    57   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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    42   1.10000 -1.0 2.0
   44    43    42    37   1.10000 -1.0 2.0
   61    70    66    67  15.00000 -1.0 2.0
   68    69    67    66  15.00000 -1.0 2.0
END
