* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    121    188     360
    1     0 S   NP   _N1_     1    28.86947    96.02813   -25.02252
    2     1 S   H    _HN1     2     1.02946    71.75949     8.29467
    3     1 S   H    _H1_     3     1.02827    35.37283  -174.49662
    4     1 S   H    _H2_     4     1.02793   118.14496   -93.24510
    5     1 S   CT   _CA1     5     1.50124   125.83016   110.72596
    6     5 S   HC   _HA1     6     1.09573   105.15899    95.97776
    7     5 S   CO3  _C1_     7     1.53760   112.44563   -24.23822
    8     7 S   O2Z  _O11     8     1.26378   114.99992   -42.94430
    9     7 S   O2Z  _O12     9     1.26230   114.93500   136.03327
   10     5 S   CT   _CB1    10     1.53054   107.40589  -146.05245
   11    10 S   HC   HB11    11     1.09843   109.32975   -49.26310
   12    10 S   HC   HB12    12     1.09810   110.48120    67.32478
   13    10 S   CT   _CG1    13     1.53033   112.64901  -170.18274
   14    13 S   HC   HG11    14     1.09565   110.76729   -67.63743
   15    13 S   HC   HG12    15     1.09668   109.67695    51.62108
   16    13 S   C    _CD1    16     1.51815   111.88904   172.13044
   17    16 S   O    _OE1    17     1.22769   123.14316    14.24887
   18    16 S   N    _N2_    18     1.38653   111.91620  -165.90817
   19    18 S   H    _HN2    19     1.01586   119.01416     0.77228
   20    18 S   CT1  _CA2    20     1.46186   123.26989   175.87056
   21    20 S   HC   _HA2    21     1.09744   109.26237     6.13517
   22    20 S   C    _C2_    22     1.53661   108.85964  -109.27964
   23    22 S   O    _O2_    23     1.23077   122.19942  -149.41164
   24    20 S   CT   _CB2    32     1.53329   111.79527   128.08323
   25    24 S   HC   HB21    33     1.09576   110.20106    57.00230
   26    24 S   HC   HB22    34     1.09424   109.79027   176.07704
   27    22 S   N    _N3_    24     1.38298   113.83814    38.10775
   28    27 S   H    _HN3    25     1.01552   119.59249    -3.37922
   29    24 S   S    _SG2    35     1.82657   111.53749   -63.96133
   30    27 S   CT   _CA3    26     1.45282   123.33123   177.17340
   31    30 S   HC   HA31    27     1.09546   107.51814   -64.73817
   32    30 S   HC   HA32    28     1.09553   107.99957    51.73332
   33    29 S   CT   _C13    36     1.84728    99.69853   177.04269
   34    33 S   HC   _H5_    37     1.09673   105.34211   -47.35360
   35    30 S   CO3  _C3_    29     1.52988   114.00038   173.71918
   36    35 S   O2Z  _O31    30     1.26391   116.05910    -0.64498
   37    35 S   O2Z  _O32    31     1.26422   114.42380   179.41684
   38    33 S   CM   _C6_    38     1.53653   108.59547  -163.35123
   39    33 S   CT   _C12    52     1.54304   114.26527    67.74584
   40    39 S   HC   _H17    53     1.09839   108.09534   -72.34871
   41    39 S   HC   _H18    54     1.09732   109.22233   174.63984
   42    38 S   CT   _C7_    39     1.52087   117.47440   -84.17683
   43    42 S   HC   _H3_    40     1.09511   110.60519   146.84833
   44    38 S   CMA  _C5_    58     1.36602   120.43536    96.29971
   45    44 S   OM   _O33    59     1.26365   130.21122    -1.93158
   46    42 S   CT   _C8_    41     1.53446   112.47303   -88.64690
   47    46 S   HC   _H9_    42     1.09608   112.56180    -7.02817
   48    46 S   HC   _H10    43     1.09659   110.45886  -125.58127
   49    44 S   CT   _C4_    60     1.52440   120.27413   177.48238
   50    49 S   HC   _H6_    61     1.09679   110.30288    89.99448
   51    49 S   HC   _H7_    62     1.09466   112.61853   -31.18936
   52    49 S   HC   _H8_    63     1.09919   112.63377  -149.49025
   53    46 S   CT   _C9_    44     1.52341   106.90354   114.89660
   54    53 S   HC   _H11    45     1.09731   108.96381   105.27861
   55    53 S   HC   _H12    46     1.09466   112.22311  -136.43769
   56    53 S   CT   _C10    47     1.51855   106.16044   -12.57117
   57    56 S   HC   _H4_    48     1.09556   111.10273   144.25236
   58    56 S   CT   _C11    49     1.52799   115.32600   -90.51865
   59    58 S   HC   _H15    50     1.09818   107.85412   -62.48923
   60    58 S   HC   _H16    51     1.09694   108.85986  -175.99841
   61    42 S   NP   _N4_    55     1.50485   114.54874    29.65981
   62    61 S   H    _H13    56     1.03059   111.80432    30.31020
   63    61 S   H    _H14    57     1.02918   109.18740   147.34245
  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   9   5   4   3
  16   7   2   1   1  20  11   5   4  16   9   7   4  11   6   5
   3   2   1   1  10   5   4   7   6   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    58    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    56    58    59    60    39    40    41    61    44    45    49  
   38    42    58    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    47    48    53    56    58    39    40    41    61    62    63    44    45    49    50    51    52  
   40    41    61    44    42    53    56    57    58    59    60  
   41    56    58    59    60  
   56    58    59    60  
   43    46    47    48    53    54    55    56    57    58    61    62    63    44    45    49  
   46    47    48    53    56    61    62    63    44  
   45    49    50    51    52    46    61  
   49    50    51    52  
   47    48    53    54    55    56    57    58    61    62    63  
   48    53    54    55    56    61  
   53    54    55    56    61  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    57    58    59    60    61    62    63  
   55    56    57    58    61  
   56    57    58    61  
   57    58    59    60    61    62    63  
   58    59    60    61    62    63  
   59    60    61    62    63  
   60    61  
   61  
   62    63  
   63  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   56   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   3.2500   0.1700  -0.200000   2.1950   1.9500   0.003973653   1.685851020
   62   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
   63   0.5000   0.0300   0.310000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   317.000  1.510
   33    39   268.000  1.529
   38    42   317.000  1.510
   38    44   465.000  1.376
   42    43   340.000  1.090
   42    46   268.000  1.529
   42    61   367.000  1.471
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    61   367.000  1.471
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   61    62   434.000  1.010
   61    63   434.000  1.010
   44    45   745.000  1.250
   44    49   270.000  1.512
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    65.00000  117.92700
   33    38    44    70.00000  124.00000
   33    39    58    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  109.50000
   38    42    46    70.00000  112.02700
   38    42    61    75.00000  110.06800
   38    44    45    65.00000  137.10300
   38    44    49    65.00000  122.18000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    53    58.35000  112.70000
   42    61    56    75.00000  113.01200
   42    61    62    35.00000  109.50000
   42    61    63    35.00000  109.50000
   46    42    43    37.50000  110.70000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    56    58.35000  112.70000
   48    46    47    33.00000  107.80000
   53    46    47    37.50000  110.70000
   53    46    48    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    58.35000  112.70000
   53    56    61    80.00000  111.20000
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    60    37.50000  110.70000
   56    58    39    58.35000  112.70000
   56    61    62    35.00000  109.50000
   56    61    63    35.00000  109.50000
   58    56    57    37.50000  110.70000
   58    39    40    37.50000  110.70000
   58    39    41    37.50000  110.70000
   60    58    59    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    58    59    37.50000  110.70000
   39    58    60    37.50000  110.70000
   41    39    40    33.00000  107.80000
   61    42    43    35.00000  109.50000
   61    42    46    80.00000  111.20000
   61    56    57    35.00000  109.50000
   61    56    58    80.00000  111.20000
   63    61    62    35.00000  109.50000
   44    38    42    70.00000  124.00000
   44    49    50    45.00000  110.52000
   44    49    51    45.00000  110.52000
   44    49    52    45.00000  110.52000
   49    44    45    85.00000  112.85300
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    38    42   0.30250  1.0 1.0
   29    33    38    42  -0.14950 -1.0 2.0
   29    33    38    42   0.36900  1.0 3.0
   29    33    38    44   0.42700  1.0 1.0
   29    33    38    44  -0.70350 -1.0 2.0
   29    33    38    44  -0.43150  1.0 3.0
   29    33    39    58   0.44750  1.0 1.0
   29    33    39    58  -0.17800 -1.0 2.0
   29    33    39    58   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    38    42    43   0.34800  1.0 3.0
   33    38    42    46   0.46850  1.0 1.0
   33    38    42    46   0.08550 -1.0 2.0
   33    38    42    46   0.09800  1.0 3.0
   33    38    42    61   0.52100  1.0 1.0
   33    38    42    61  -0.20350 -1.0 2.0
   33    38    42    61   0.29750  1.0 3.0
   33    38    44    45   7.00000 -1.0 2.0
   33    38    44    49   7.00000 -1.0 2.0
   34    33    38    42   0.34800  1.0 3.0
   34    33    38    44   0.00000  1.0 1.0
   34    33    39    58   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   38    33    39    58   0.34400  1.0 1.0
   38    33    39    58   0.09450 -1.0 2.0
   38    33    39    58   0.11100  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    42    46    47   0.15000  1.0 3.0
   38    42    46    48   0.15000  1.0 3.0
   38    42    46    53   0.34400  1.0 1.0
   38    42    46    53   0.09450 -1.0 2.0
   38    42    46    53   0.11100  1.0 3.0
   38    42    61    56   0.08000 -1.0 2.0
   38    42    61    62   0.17350  1.0 3.0
   38    42    61    63   0.17350  1.0 3.0
   38    44    49    50   0.00000  1.0 1.0
   38    44    49    51   0.00000  1.0 1.0
   38    44    49    52   0.00000  1.0 1.0
   42    38    44    45   7.00000 -1.0 2.0
   42    38    44    49   7.00000 -1.0 2.0
   42    46    53    54   0.15000  1.0 3.0
   42    46    53    55   0.15000  1.0 3.0
   42    46   -53    56   0.56750  1.0 1.0
   42    46   -53    56  -0.07550 -1.0 2.0
   42    46   -53    56   0.20000  1.0 3.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    53   0.15000  1.0 3.0
   43    42    61    56   0.15000  1.0 3.0
   43    42    61    62   0.13050  1.0 3.0
   43    42    61    63   0.13050  1.0 3.0
   46    42   -61    56   0.47100  1.0 1.0
   46    42    61    62   0.17350  1.0 3.0
   46    42    61    63   0.17350  1.0 3.0
   46    53    56    57   0.15000  1.0 3.0
   46    53    56    58   0.56750  1.0 1.0
   46    53    56    58  -0.07550 -1.0 2.0
   46    53    56    58   0.20000  1.0 3.0
   46    53   -56    61   1.36600  1.0 1.0
   46    53   -56    61  -0.11450 -1.0 2.0
   46    53   -56    61   0.24250  1.0 3.0
   47    46    53    54   0.15000  1.0 3.0
   47    46    53    55   0.15000  1.0 3.0
   47    46    53    56   0.15000  1.0 3.0
   48    46    53    54   0.15000  1.0 3.0
   48    46    53    55   0.15000  1.0 3.0
   48    46    53    56   0.15000  1.0 3.0
   53    56    58    59   0.15000  1.0 3.0
   53    56    58    60   0.15000  1.0 3.0
   53    56    58    39   0.56750  1.0 1.0
   53    56    58    39  -0.07550 -1.0 2.0
   53    56    58    39   0.20000  1.0 3.0
   53    56   -61    42   0.47100  1.0 1.0
   53    56    61    62   0.17350  1.0 3.0
   53    56    61    63   0.17350  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    61   0.19200  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   55    53    56    61   0.19200  1.0 3.0
   56    58    39    33   0.56750  1.0 1.0
   56    58    39    33  -0.07550 -1.0 2.0
   56    58    39    33   0.20000  1.0 3.0
   56    58    39    40   0.15000  1.0 3.0
   56    58    39    41   0.15000  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    60   0.15000  1.0 3.0
   57    56    58    39   0.15000  1.0 3.0
   57    56    61    42   0.15000  1.0 3.0
   57    56    61    62   0.13050  1.0 3.0
   57    56    61    63   0.13050  1.0 3.0
   58    56    61    42   0.47100  1.0 1.0
   58    56    61    62   0.17350  1.0 3.0
   58    56    61    63   0.17350  1.0 3.0
   59    58    39    33   0.15000  1.0 3.0
   59    58    39    40   0.15000  1.0 3.0
   59    58    39    41   0.15000  1.0 3.0
   60    58    39    33   0.15000  1.0 3.0
   60    58    39    40   0.15000  1.0 3.0
   60    58    39    41   0.15000  1.0 3.0
   39    33    38    42   0.46850  1.0 1.0
   39    33    38    42   0.08550 -1.0 2.0
   39    33    38    42   0.09800  1.0 3.0
   39    33    38    44   0.09850  1.0 1.0
   39    33    38    44   0.15250 -1.0 2.0
   39    33    38    44  -0.50650  1.0 3.0
   61    42    46    47   0.19200  1.0 3.0
   61    42    46    48   0.19200  1.0 3.0
   61    42   -46    53   1.36600  1.0 1.0
   61    42   -46    53  -0.11450 -1.0 2.0
   61    42   -46    53   0.24250  1.0 3.0
   61    56    58    59   0.19200  1.0 3.0
   61    56    58    60   0.19200  1.0 3.0
   61    56    58    39   1.36600  1.0 1.0
   61    56    58    39  -0.11450 -1.0 2.0
   61    56    58    39   0.24250  1.0 3.0
   44    38    42    43   0.00000  1.0 1.0
   44    38    42    46   0.09850  1.0 1.0
   44    38    42    46   0.15250 -1.0 2.0
   44    38    42    46  -0.50650  1.0 3.0
   44    38    42    61   0.80850  1.0 1.0
   44    38    42    61  -0.47300 -1.0 2.0
   44    38    42    61  -0.52300  1.0 3.0
   45    44    49    50   0.00000  1.0 1.0
   45    44    49    51   0.00000  1.0 1.0
   45    44    49    52   0.00000  1.0 1.0
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
   36    30    35    37  10.50000 -1.0 2.0
   33    42    38    44   1.10000 -1.0 2.0
   49    45    44    38   1.10000 -1.0 2.0
END
