* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    130    204     372
    1     0 S   NP   _N1_     1    29.55001    98.01191   -18.59307
    2     1 S   H    _HN1     2     1.02791    88.43464  -116.45353
    3     1 S   H    _H1_     3     1.02934    59.33883    -4.04186
    4     1 S   H    _H2_     4     1.02828    61.10681   132.13716
    5     1 S   CT   _CA1     5     1.50174   159.50511    60.90064
    6     5 S   HC   _HA1     6     1.09573   105.18430   122.29416
    7     5 S   CO3  _C1_     7     1.53891   111.82616     2.17475
    8     7 S   O2Z  _O11     8     1.26395   115.11392   -53.84809
    9     7 S   O2Z  _O12     9     1.26188   114.99322   124.54953
   10     5 S   CT   _CB1    10     1.53071   107.29173  -119.87553
   11    10 S   HC   HB11    11     1.09837   109.77796   -47.35579
   12    10 S   HC   HB12    12     1.09792   110.39620    69.32950
   13    10 S   CT   _CG1    13     1.52955   112.37841  -168.06694
   14    13 S   HC   HG11    14     1.09538   110.60125   -60.85245
   15    13 S   HC   HG12    15     1.09638   109.72503    58.26325
   16    13 S   C    _CD1    16     1.51838   111.92226   179.26939
   17    16 S   O    _OE1    17     1.22800   123.09924    14.16242
   18    16 S   N    _N2_    18     1.38406   111.97722  -166.98684
   19    18 S   H    _HN2    19     1.02042   119.17481     2.85533
   20    18 S   CT1  _CA2    20     1.46024   123.86560  -177.15208
   21    20 S   HC   _HA2    21     1.09755   108.82561     7.13952
   22    20 S   C    _C2_    22     1.53507   109.99129  -108.60929
   23    22 S   O    _O2_    23     1.23141   121.97089  -153.63975
   24    20 S   CT   _CB2    32     1.53578   111.58330   128.25686
   25    24 S   HC   HB21    33     1.09216   110.80488    65.32782
   26    24 S   HC   HB22    34     1.09572   109.86463  -177.35669
   27    22 S   N    _N3_    24     1.38297   114.07507    34.37107
   28    27 S   H    _HN3    25     1.01565   119.44681    -6.04890
   29    24 S   S    _SG2    35     1.82689   111.21899   -59.14717
   30    27 S   CT   _CA3    26     1.45264   123.12319   176.62490
   31    30 S   HC   HA31    27     1.09562   107.76173   -57.06098
   32    30 S   HC   HA32    28     1.09557   107.66579    59.27733
   33    29 S   CT   _C11    36     1.87339   101.85979   124.42698
   34    30 S   CO3  _C3_    29     1.52940   114.27554  -179.01444
   35    34 S   O2Z  _O31    30     1.26363   116.16683    -2.79064
   36    34 S   O2Z  _O32    31     1.26470   114.38260   177.19453
   37    33 S   CM   _C9_    37     1.52787   109.83418   -67.50451
   38    33 S   CT   _C12    57     1.54911   112.12766    65.51424
   39    38 S   HC   _H6_    58     1.09774   109.33584   -76.11845
   40    37 S   N4   _N4_    38     1.36387   112.57640   -88.84551
   41    37 S   CMA  _C10    54     1.51824   124.92880   102.21384
   42    41 S   OM   _O34    55     1.26310   120.05727  -114.19482
   43    41 S   OM   _O35    56     1.26178   121.65547    67.44193
   44    38 S   CT   _C13    59     1.52952   117.08996    46.16140
   45    44 S   HC   _H10    60     1.09545   111.89174    42.25358
   46    44 S   HC   _H11    61     1.09372   113.10319   -80.49777
   47    40 S   C4   _C8_    39     1.35175   132.96382  -135.10794
   48    47 S   O    _O33    40     1.20884   134.29498   -36.27341
   49    40 S   C4T  _C7_    43     1.44477   118.71578     1.63423
   50    49 S   HC   _H5_    44     1.09557   112.43449    99.24061
   51    44 S   CT   _C14    62     1.50882   101.74771   158.74436
   52    51 S   HC   _H12    63     1.09647   109.80661    78.48979
   53    51 S   HC   _H13    64     1.09308   113.75033  -160.12872
   54    47 S   C4T  _C6_    41     1.56501    89.52803   137.32535
   55    54 S   HC   _H4_    42     1.09876   111.81896  -109.55311
   56    33 S   S    _S1_    45     1.92741   104.87409  -176.00688
   57    51 S   CT   _C15    65     1.51131   101.99060   -38.12132
   58    57 S   HC   _H14    66     1.09359   112.55260   150.05650
   59    57 S   HC   _H15    67     1.09507   111.21541   -87.91167
   60    54 S   CT   _C5_    46     1.52310   115.35676   120.58445
   61    60 S   HC   _H3_    47     1.09495   110.94879   -48.95970
   62    38 S   OS   _O36    68     1.44648   111.66295   167.06137
   63    60 S   CT   _C4_    48     1.52107   111.00654    73.78651
   64    63 S   HC   _H7_    49     1.09576   110.97642    58.88841
   65    63 S   HC   _H8_    50     1.09380   111.63391   -62.00568
   66    63 S   HC   _H9_    51     1.09525   110.51768   177.17569
   67    60 S   OH   _O37    52     1.42585   108.01271  -166.95527
   68    67 S   HO   _H16    53     0.97270   107.26352   176.86731
  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  10   5   4   3
  18   2   1   1  14  15   7  11   5   1   1  10   6   5  10   4
   8   4   6   5   4  10   5   2   3   2   1   7   6   1   5   3
   2   1   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    56    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    49    56    41    38    39    44    62  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    47    54    49    50    56    41    42    43    38    39    44    45    46    51    57    62  
   35    36  
   36  
    0  
   40    47    48    54    49    50    56    41    42    43    38    39    44    62  
   39    44    45    46    51    52    53    57    58    59    62    40    41    49    56  
   44    45    46    51    57    62    56  
   47    48    54    55    49    50    56    60    41    42    43  
   42    43    47    49    56  
   43  
    0  
   45    46    51    52    53    57    58    59    62    56  
   46    51    52    53    57    62  
   51    52    53    57    62  
   48    54    55    49    50    56    60    61    63    67  
   54    55    49    60  
   50    56    60    61    63    67    54    55  
   56    60    54    55  
   52    53    57    58    59    62  
   53    57    58    59    62  
   57    58    59    62  
   55    56    60    61    63    64    65    66    67    68  
   56    60    61    63    67  
   60    62  
   58    59    62  
   59    62  
   62  
   61    63    64    65    66    67    68  
   63    64    65    66    67    68  
    0  
   64    65    66    67    68  
   65    66    67  
   66    67  
   67  
   68  
    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   0.335000   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  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   40   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   41   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   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   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   49   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   57   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   63   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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    56   222.000  1.810
   33    38   268.000  1.529
   37    40   400.000  1.384
   37    41   465.000  1.376
   40    47   440.000  1.369
   40    49   305.000  1.456
   47    48   930.000  1.212
   47    54   250.000  1.540
   54    55   340.000  1.090
   54    49   268.000  1.529
   54    60   260.000  1.519
   49    50   340.000  1.090
   49    56   200.000  1.824
   60    61   340.000  1.090
   60    63   268.000  1.529
   60    67   320.000  1.410
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   553.000  0.945
   41    42   745.000  1.250
   41    43   745.000  1.250
   38    39   340.000  1.090
   38    44   268.000  1.529
   38    62   320.000  1.410
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    62   320.000  1.410
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    56    75.00000  118.28000
   29    33    38    75.00000  111.63000
   33    37    40    70.00000  113.82800
   33    37    41    70.00000  124.00000
   33    56    49    85.00000   99.86700
   33    38    39    37.50000  110.70000
   33    38    44    58.35000  112.70000
   33    38    62    50.00000  109.50000
   37    40    47    50.00000  132.10000
   37    40    49    50.00000  132.70000
   37    41    42    65.00000  137.10300
   37    41    43    65.00000  137.10300
   40    47    48    75.00000  131.60000
   40    47    54    95.00000   92.72400
   40    49    54   105.00000   87.49700
   40    49    50    50.00000  112.01000
   40    49    56    80.00000  108.62000
   47    54    55    40.00000  113.37500
   47    54    49   100.00000   86.36000
   47    54    60    63.00000  111.10000
   54    47    48    60.00000  136.58000
   54    49    50    37.50000  110.70000
   54    49    56    65.00000  119.05700
   54    60    61    45.00000  111.22300
   54    60    63    70.00000  112.98000
   54    60    67    50.00000  109.50000
   49    40    47   100.00000   93.00000
   49    54    55    37.50000  110.70000
   56    33    37    75.00000  112.20000
   56    49    50    45.00000  109.41400
   60    54    55    45.00000  112.72800
   60    54    49    65.00000  119.52000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    37.50000  110.70000
   60    67    68    55.00000  108.50000
   63    60    61    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    60    61    35.00000  109.50000
   67    60    63    50.00000  109.50000
   41    37    40    75.00000  120.83300
   43    41    42    65.00000  121.00000
   38    33    37    70.00000  112.02700
   38    33    56    75.00000  111.63000
   38    44    45    37.50000  110.70000
   38    44    46    37.50000  110.70000
   38    44    51    58.35000  112.70000
   38    62    57    60.00000  109.50000
   44    38    39    37.50000  110.70000
   44    51    52    37.50000  110.70000
   44    51    53    37.50000  110.70000
   44    51    57    58.35000  112.70000
   46    44    45    33.00000  107.80000
   51    44    45    37.50000  110.70000
   51    44    46    37.50000  110.70000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    62    50.00000  109.50000
   53    51    52    33.00000  107.80000
   57    51    52    37.50000  110.70000
   57    51    53    37.50000  110.70000
   59    57    58    33.00000  107.80000
   62    38    39    35.00000  109.50000
   62    38    44    50.00000  109.50000
   62    57    58    35.00000  109.50000
   62    57    59    35.00000  109.50000
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    56   0.08500  1.0 1.0
   24    29    33    56  -0.53150 -1.0 2.0
   24    29    33    56   0.48050  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    56    49   0.08500  1.0 1.0
   29    33    56    49  -0.53150 -1.0 2.0
   29    33    56    49   0.48050  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    44   0.44750  1.0 1.0
   29    33    38    44  -0.17800 -1.0 2.0
   29    33    38    44   0.20200  1.0 3.0
   29    33    38    62   0.56750  1.0 1.0
   29    33    38    62  -0.07550 -1.0 2.0
   29    33    38    62   0.20000  1.0 3.0
   33    37    40    47   0.00000  1.0 1.0
   33    37   -40    49   0.00000  1.0 1.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    43   7.00000 -1.0 2.0
   33    38    44    45   0.15000  1.0 3.0
   33    38    44    46   0.15000  1.0 3.0
   33    38    44    51   0.56750  1.0 1.0
   33    38    44    51  -0.07550 -1.0 2.0
   33    38    44    51   0.20000  1.0 3.0
   33    38    62    57   0.06250  1.0 1.0
   33    38    62    57  -0.01100 -1.0 2.0
   33    38    62    57   0.28050  1.0 3.0
   37    33   -56    49  -0.70200  1.0 1.0
   37    33   -56    49  -0.14350 -1.0 2.0
   37    33   -56    49   0.55200  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    44   0.34400  1.0 1.0
   37    33    38    44   0.09450 -1.0 2.0
   37    33    38    44   0.11100  1.0 3.0
   37    33    38    62   0.61850  1.0 1.0
   37    33    38    62  -0.22750 -1.0 2.0
   37    33    38    62   0.15300  1.0 3.0
   37    40    47    48   3.00000 -1.0 2.0
   37    40    47    54   3.00000 -1.0 2.0
   37    40   -49    54   0.00000  1.0 1.0
   37    40    49    50   0.00000  1.0 1.0
   37    40   -49    56   0.00000  1.0 1.0
   40    37    41    42   7.00000 -1.0 2.0
   40    37    41    43   7.00000 -1.0 2.0
   40    47    54    55   0.00000  1.0 1.0
   40    47   -54    49   3.00000 -1.0 2.0
   40    47    54    60   1.39750  1.0 1.0
   40    47    54    60  -0.07950 -1.0 2.0
   40    47    54    60  -0.18750  1.0 3.0
   40    49   -56    33   0.01700  1.0 1.0
   40    49   -56    33  -0.23550 -1.0 2.0
   40    49   -56    33   0.21350  1.0 3.0
   47    40   -49    54   0.00000  1.0 1.0
   47    40    49    50   0.00000  1.0 1.0
   47    40    49    56   0.00000  1.0 1.0
   47    54   -49    40   3.00000 -1.0 2.0
   47    54   -49    50   0.15000  1.0 3.0
   47    54   -49    56   0.00000  1.0 1.0
   47    54    60    61  -0.11250  1.0 3.0
   47    54    60    63  -0.95700  1.0 1.0
   47    54    60    63  -0.18200 -1.0 2.0
   47    54    60    63   0.29450  1.0 3.0
   47    54    60    67  -0.09450  1.0 1.0
   47    54    60    67  -1.12950 -1.0 2.0
   47    54    60    67   0.54000  1.0 3.0
   48    47    54    55   0.00000  1.0 1.0
   48    47    54    49  -0.11250  1.0 1.0
   48    47    54    49   0.11400 -1.0 2.0
   48    47    54    49  -0.28950  1.0 3.0
   48    47    54    60   0.30150 -1.0 2.0
   54    49    56    33   0.25150  1.0 1.0
   54    49    56    33  -1.17200 -1.0 2.0
   54    49    56    33   0.53050  1.0 3.0
   54    60    63    64   0.15000  1.0 3.0
   54    60    63    65   0.15000  1.0 3.0
   54    60    63    66   0.15000  1.0 3.0
   54    60    67    68  -0.11600  1.0 1.0
   54    60    67    68  -0.09450 -1.0 2.0
   54    60    67    68   0.21250  1.0 3.0
   55    54   -49    40   0.15000  1.0 3.0
   55    54    49    50   0.15000  1.0 3.0
   55    54    49    56   0.00000  1.0 1.0
   55    54    60    61   0.15000  1.0 3.0
   55    54    60    63   0.15000  1.0 3.0
   55    54    60    67   0.23400  1.0 3.0
   49    40   -47    48   3.00000 -1.0 2.0
   49    40   -47    54   3.00000 -1.0 2.0
   49    54    60    61   0.00000  1.0 1.0
   49    54    60    63   0.04050  1.0 1.0
   49    54    60    63   0.63700 -1.0 2.0
   49    54    60    63   0.17650  1.0 3.0
   49    54    60    67   0.86500  1.0 1.0
   49    54    60    67  -0.17500 -1.0 2.0
   49    54    60    67   0.20800  1.0 3.0
   50    49    56    33   0.00000  1.0 1.0
   56    33   -37    40   0.09700  1.0 1.0
   56    33   -37    40   0.15600 -1.0 2.0
   56    33   -37    40  -0.50800  1.0 3.0
   56    33    37    41   0.42700  1.0 1.0
   56    33    37    41  -0.70350 -1.0 2.0
   56    33    37    41  -0.43150  1.0 3.0
   56    33    38    39   0.15000  1.0 3.0
   56    33    38    44   0.44750  1.0 1.0
   56    33    38    44  -0.17800 -1.0 2.0
   56    33    38    44   0.20200  1.0 3.0
   56    33    38    62   0.56750  1.0 1.0
   56    33    38    62  -0.07550 -1.0 2.0
   56    33    38    62   0.20000  1.0 3.0
   60    54   -49    40   0.43900  1.0 1.0
   60    54   -49    40   0.49100 -1.0 2.0
   60    54   -49    40   0.28400  1.0 3.0
   60    54    49    50   0.15000  1.0 3.0
   60    54    49    56   0.44750  1.0 1.0
   60    54    49    56  -0.17800 -1.0 2.0
   60    54    49    56   0.20200  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.15000  1.0 3.0
   61    60    67    68   0.19450  1.0 3.0
   63    60    67    68  -0.11600  1.0 1.0
   63    60    67    68  -0.09450 -1.0 2.0
   63    60    67    68   0.21250  1.0 3.0
   67    60    63    64   0.23400  1.0 3.0
   67    60    63    65   0.23400  1.0 3.0
   67    60    63    66   0.23400  1.0 3.0
   41    37    40    47   0.00000  1.0 1.0
   41    37    40    49   0.00000  1.0 1.0
   38    33    37    40  -0.93550  1.0 1.0
   38    33    37    40   0.38900 -1.0 2.0
   38    33    37    40   0.16950  1.0 3.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    56    49  -0.25000 -1.0 2.0
   38    33    56    49  -0.01800  1.0 3.0
   38    44    51    52   0.15000  1.0 3.0
   38    44    51    53   0.15000  1.0 3.0
   38    44   -51    57   0.56750  1.0 1.0
   38    44   -51    57  -0.07550 -1.0 2.0
   38    44   -51    57   0.20000  1.0 3.0
   39    38    44    45   0.15000  1.0 3.0
   39    38    44    46   0.15000  1.0 3.0
   39    38    44    51   0.15000  1.0 3.0
   39    38    62    57   0.37050  1.0 3.0
   44    38   -62    57   0.06250  1.0 1.0
   44    38   -62    57  -0.01100 -1.0 2.0
   44    38   -62    57   0.28050  1.0 3.0
   44    51    57    58   0.15000  1.0 3.0
   44    51    57    59   0.15000  1.0 3.0
   44    51   -57    62   0.62750  1.0 1.0
   44    51   -57    62  -0.30950 -1.0 2.0
   44    51   -57    62   0.27300  1.0 3.0
   45    44    51    52   0.15000  1.0 3.0
   45    44    51    53   0.15000  1.0 3.0
   45    44    51    57   0.15000  1.0 3.0
   46    44    51    52   0.15000  1.0 3.0
   46    44    51    53   0.15000  1.0 3.0
   46    44    51    57   0.15000  1.0 3.0
   51    57   -62    38   0.06250  1.0 1.0
   51    57   -62    38  -0.01100 -1.0 2.0
   51    57   -62    38   0.28050  1.0 3.0
   52    51    57    58   0.15000  1.0 3.0
   52    51    57    59   0.15000  1.0 3.0
   52    51    57    62   0.23400  1.0 3.0
   53    51    57    58   0.15000  1.0 3.0
   53    51    57    59   0.15000  1.0 3.0
   53    51    57    62   0.23400  1.0 3.0
   58    57    62    38   0.37050  1.0 3.0
   59    57    62    38   0.37050  1.0 3.0
   62    38    44    45   0.23400  1.0 3.0
   62    38    44    46   0.23400  1.0 3.0
   62    38   -44    51   0.62750  1.0 1.0
   62    38   -44    51  -0.30950 -1.0 2.0
   62    38   -44    51   0.27300  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    40    37    41   1.10000 -1.0 2.0
   49    47    40    37   1.00000 -1.0 2.0
   40    54    47    48  10.50000 -1.0 2.0
   42    43    41    37   1.10000 -1.0 2.0
END
