* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    119    179     345
    1     0 S   NP   _N1_     1    32.03573   100.05273   -20.24689
    2     1 S   H    _HN1     2     1.03477   159.48834   -88.91861
    3     1 S   H    _H1_     3     1.02821    54.97036  -124.53448
    4     1 S   H    _H2_     4     1.02735    89.58292   123.83776
    5     1 S   CT   _CA1     5     1.50159    69.82519    11.40261
    6     5 S   HC   _HA1     6     1.09450   104.85677   136.81353
    7     5 S   CO3  _C1_     7     1.53988   113.31788    16.63866
    8     7 S   O2Z  _O11     8     1.26477   115.07818   -19.36688
    9     7 S   O2Z  _O12     9     1.26244   115.37445   160.39638
   10     5 S   CT   _CB1    10     1.53168   107.51172  -104.37120
   11    10 S   HC   HB11    11     1.09606   109.77536   -35.31395
   12    10 S   HC   HB12    12     1.09837   109.98783    80.25034
   13    10 S   CT   _CG1    13     1.53418   112.99585  -158.36342
   14    13 S   HC   HG11    14     1.09571   110.53233  -105.11756
   15    13 S   HC   HG12    15     1.09607   112.09821    14.23842
   16    13 S   C    _CD1    16     1.51497   110.10994   134.80361
   17    16 S   O    _OE1    17     1.22806   122.09749    99.91269
   18    16 S   N    _N2_    18     1.38362   112.39799   -77.71610
   19    18 S   H    _HN2    19     1.02069   119.14830    -5.76674
   20    18 S   CT1  _CA2    20     1.45910   123.31935   175.30781
   21    20 S   HC   _HA2    21     1.09666   108.60673    34.44243
   22    20 S   C    _C2_    22     1.53183   108.63300   -82.53378
   23    22 S   O    _O2_    23     1.23107   121.25389   150.26364
   24    20 S   CT   _CB2    32     1.53253   111.82396   158.00274
   25    24 S   HC   HB21    33     1.09398   109.65330    61.74863
   26    24 S   HC   HB22    34     1.09518   109.79108   179.47362
   27    22 S   N    _N3_    24     1.38389   114.18541   -37.25703
   28    27 S   H    _HN3    25     1.01644   119.10313     1.84292
   29    24 S   S    _SG2    35     1.83002   111.26978   -60.52389
   30    27 S   CT   _CA3    26     1.45218   123.33836  -177.04349
   31    30 S   HC   HA31    27     1.09560   108.20809   -45.16588
   32    30 S   HC   HA32    28     1.09545   107.24719    71.21172
   33    29 S   CT   _C14    36     1.87544   100.82468   154.46686
   34    33 S   OM   _O37    37     1.32177   108.48768   177.48060
   35    30 S   CO3  _C3_    29     1.52991   114.38338  -167.49222
   36    35 S   O2Z  _O31    30     1.26406   116.35962    -1.22605
   37    35 S   O2Z  _O32    31     1.26452   114.38617   178.51457
   38    33 S   CM   _C8_    38     1.53602   109.72770    60.17496
   39    33 S   CM   _C12    50     1.52742   109.19712   -64.52748
   40    38 S   CM   _C7_    39     1.35283   122.88009    44.73276
   41    40 S   HC   _H8_    40     1.08268   123.54624     3.23265
   42    39 S   CO3  _C13    51     1.55769   119.50717   -46.94300
   43    42 S   O2Z  _O35    52     1.26884   115.36969    95.91088
   44    42 S   O2Z  _O36    53     1.26625   115.59372   -84.16861
   45    40 S   OS   _O33    41     1.36973   127.77418  -177.13625
   46    45 S   CT   _C6_    42     1.43121   114.33469    12.03498
   47    46 S   HC   _H4_    43     1.09746   105.89799  -159.87399
   48    46 S   CT   _C5_    44     1.54059   112.30180   -41.69865
   49    48 S   HC   _H3_    45     1.09556   105.94235   175.38514
   50    46 S   CT   _C16    62     1.53183   109.65477    85.41078
   51    50 S   HC   _H12    63     1.09447   112.24181   -63.31953
   52    50 S   HC   _H13    64     1.09435   111.01461   175.19845
   53    50 S   HC   _H14    65     1.09554   110.07485    55.05740
   54    38 S   CM   _C9_    46     1.47318   117.83484  -137.47195
   55    48 S   CT   _C4_    58     1.53631   111.02945   -67.99793
   56    55 S   HC   _H5_    59     1.09520   112.37096    61.32669
   57    55 S   HC   _H6_    60     1.09545   110.41599   -58.88157
   58    55 S   HC   _H7_    61     1.09547   111.06754  -178.02543
   59    54 S   CM   _C10    47     1.35931   122.53254    10.33993
   60    59 S   CMA  _C11    48     1.49692   121.32671     3.15244
   61    60 S   OM   _O34    49     1.26508   112.23851   169.52587
   62    59 S   CT   _C15    54     1.52691   120.93872  -174.78342
   63    62 S   HC   _H9_    55     1.09677   111.10670   131.19938
   64    62 S   HC   _H10    56     1.09177   113.99045    13.55891
   65    62 S   HC   _H11    57     1.09569   110.52457  -107.54074
  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   8   5   4   3
  14   6   2   1   1  13   9   8   3   5   2   1  10  13   8  13
   7   5   2   1   1  11   4   2   1   1   6   5   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    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    40    54    60    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    45    48    54    59    60    61    39    42    43    44  
   38    40    54    60    39    42  
   36    37  
   37  
    0  
   40    41    45    46    48    49    54    59    60    39    42    62    55  
   42    43    44    62    40    54    59    60    61  
   41    45    46    47    48    54    59    50  
   45    46    54  
   43    44    59    60    61  
   44    60  
   60  
   46    47    48    49    54    55    50    51    52    53  
   47    48    49    54    59    55    56    57    58    50    51    52    53  
   48    49    54    55    50    51    52    53  
   49    54    59    60    62    55    56    57    58    50    51    52    53  
   54    59    55    56    57    58    50  
   51    52    53    54    55  
   52    53  
   53  
    0  
   59    60    61    62    63    64    65    55    56    57    58  
   56    57    58    59  
   57    58  
   58  
    0  
   60    61    62    63    64    65  
   61    62    63    64    65  
   62  
   63    64    65  
   64    65  
   65  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.911500   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760  -0.030000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   60   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   61   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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   570.000  1.307
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    40   549.000  1.340
   38    54   380.000  1.444
   40    41   340.000  1.080
   40    45   440.000  1.360
   45    46   320.000  1.410
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   268.000  1.529
   48    49   340.000  1.090
   48    54   317.000  1.510
   48    55   268.000  1.529
   54    59   549.000  1.340
   59    60   465.000  1.376
   59    62   317.000  1.510
   60    61   745.000  1.250
   60    39   465.000  1.376
   39    42   230.000  1.545
   42    43   656.000  1.250
   42    44   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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    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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  112.20000
   33    38    40    70.00000  124.00000
   33    38    54    70.00000  124.00000
   33    39    60    70.00000  124.00000
   33    39    42    65.00000  117.04000
   38    33    34    85.00000  110.90400
   38    40    41    35.00000  120.00000
   38    40    45    80.00000  120.01400
   38    54    48    70.00000  124.00000
   38    54    59    70.00000  123.01800
   40    45    46    90.00000  111.18400
   45    40    41    55.00000  109.52600
   45    46    47    35.00000  109.50000
   45    46    48    50.00000  109.50000
   45    46    50    50.00000  109.50000
   46    48    49    37.50000  110.70000
   46    48    54    70.00000  112.02700
   46    48    55    58.35000  112.70000
   46    50    51    37.50000  110.70000
   46    50    52    37.50000  110.70000
   46    50    53    37.50000  110.70000
   48    46    47    37.50000  110.70000
   48    54    59    70.00000  124.00000
   48    55    56    37.50000  110.70000
   48    55    57    37.50000  110.70000
   48    55    58    37.50000  110.70000
   54    38    40    70.00000  123.01800
   54    48    49    35.00000  109.50000
   54    59    60    70.00000  117.34000
   54    59    62    70.00000  124.00000
   59    60    61    65.00000  137.10300
   59    60    39    70.00000  123.01800
   59    62    63    35.00000  109.50000
   59    62    64    35.00000  109.50000
   59    62    65    35.00000  109.50000
   60    39    42    55.00000  124.75400
   39    33    34    85.00000  110.90400
   39    33    38    70.00000  110.12100
   39    60    61    65.00000  137.10300
   39    42    43    85.00000  113.83300
   39    42    44    85.00000  113.83300
   44    42    43    80.00000  126.00000
   62    59    60    70.00000  124.00000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   55    48    49    37.50000  110.70000
   55    48    54    70.00000  112.02700
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   50    46    47    37.50000  110.70000
   50    46    48    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    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    38    54   0.42700  1.0 1.0
   29    33    38    54  -0.70350 -1.0 2.0
   29    33    38    54  -0.43150  1.0 3.0
   29    33    39    60   0.42700  1.0 1.0
   29    33    39    60  -0.70350 -1.0 2.0
   29    33    39    60  -0.43150  1.0 3.0
   29    33    39    42   0.09700  1.0 1.0
   29    33    39    42   0.15600 -1.0 2.0
   29    33    39    42  -0.50800  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    45   7.00000 -1.0 2.0
   33    38    54    48   0.35650  1.0 1.0
   33    38    54    48   0.31450 -1.0 2.0
   33    38    54    59  -0.18600  1.0 3.0
   33    39    42    43  -0.64400  1.0 1.0
   33    39    42    43   0.26850 -1.0 2.0
   33    39    42    44  -0.64400  1.0 1.0
   33    39    42    44   0.26850 -1.0 2.0
   34    33    38    40   0.39000  1.0 1.0
   34    33    38    40  -0.05800 -1.0 2.0
   34    33    38    40  -0.55150  1.0 3.0
   34    33    38    54   0.39000  1.0 1.0
   34    33    38    54  -0.05800 -1.0 2.0
   34    33    38    54  -0.55150  1.0 3.0
   34    33    39    60   0.39000  1.0 1.0
   34    33    39    60  -0.05800 -1.0 2.0
   34    33    39    60  -0.55150  1.0 3.0
   34    33    39    42   0.09700  1.0 1.0
   34    33    39    42   0.15600 -1.0 2.0
   34    33    39    42  -0.50800  1.0 3.0
   38    33    39    60  -0.28300  1.0 1.0
   38    33    39    60   0.26700 -1.0 2.0
   38    33    39    60  -0.63300  1.0 3.0
   38    33    39    42   0.09700  1.0 1.0
   38    33    39    42   0.15600 -1.0 2.0
   38    33    39    42  -0.50800  1.0 3.0
   38    40    45    46  -2.26850  1.0 1.0
   38    40    45    46   3.39050 -1.0 2.0
   38    54   -59    60   7.00000 -1.0 2.0
   38    54    59    62   7.00000 -1.0 2.0
   40    38    54    48  -0.18600  1.0 3.0
   40    38    54    59   0.28850  1.0 1.0
   40    38    54    59   2.61350 -1.0 2.0
   40    38    54    59   0.78400  1.0 3.0
   40    45    46    47   0.08050  1.0 3.0
   40    45   -46    48  -0.46850  1.0 1.0
   40    45   -46    48   0.09300 -1.0 2.0
   40    45   -46    48  -0.12850  1.0 3.0
   40    45    46    50  -0.46850  1.0 1.0
   40    45    46    50   0.09300 -1.0 2.0
   40    45    46    50  -0.12850  1.0 3.0
   41    40    45    46   0.50000 -1.0 2.0
   45    46    48    49   0.23400  1.0 3.0
   45    46    48    54   0.61850  1.0 1.0
   45    46    48    54  -0.22750 -1.0 2.0
   45    46    48    54   0.15300  1.0 3.0
   45    46    48    55   0.62750  1.0 1.0
   45    46    48    55  -0.30950 -1.0 2.0
   45    46    48    55   0.27300  1.0 3.0
   45    46    50    51   0.23400  1.0 3.0
   45    46    50    52   0.23400  1.0 3.0
   45    46    50    53   0.23400  1.0 3.0
   46    48   -54    38   0.98200  1.0 1.0
   46    48   -54    38  -0.11900 -1.0 2.0
   46    48   -54    38   0.24250  1.0 3.0
   46    48    54    59   0.09850  1.0 1.0
   46    48    54    59   0.15250 -1.0 2.0
   46    48    54    59  -0.50650  1.0 3.0
   46    48    55    56   0.15000  1.0 3.0
   46    48    55    57   0.15000  1.0 3.0
   46    48    55    58   0.15000  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    54   0.15000  1.0 3.0
   47    46    48    55   0.15000  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    52   0.15000  1.0 3.0
   47    46    50    53   0.15000  1.0 3.0
   48    46    50    51   0.15000  1.0 3.0
   48    46    50    52   0.15000  1.0 3.0
   48    46    50    53   0.15000  1.0 3.0
   48    54    59    60   7.00000 -1.0 2.0
   48    54    59    62   7.00000 -1.0 2.0
   49    48    54    38   0.00000  1.0 1.0
   49    48    54    59   0.00000  1.0 1.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   49    48    55    58   0.15000  1.0 3.0
   54    38    40    41   7.00000 -1.0 2.0
   54    38   -40    45   7.00000 -1.0 2.0
   54    48    55    56   0.15000  1.0 3.0
   54    48    55    57   0.15000  1.0 3.0
   54    48    55    58   0.15000  1.0 3.0
   54    59    60    61   7.00000 -1.0 2.0
   54    59    60    39   7.00000 -1.0 2.0
   54    59    62    63   0.00000  1.0 1.0
   54    59    62    64   0.00000  1.0 1.0
   54    59    62    65   0.00000  1.0 1.0
   59    60   -39    33   7.00000 -1.0 2.0
   59    60    39    42   7.00000 -1.0 2.0
   60    59    62    63   0.00000  1.0 1.0
   60    59    62    64   0.00000  1.0 1.0
   60    59    62    65   0.00000  1.0 1.0
   60    39    42    43  -0.04000 -1.0 2.0
   60    39    42    43  -0.29050  1.0 3.0
   60    39    42    44  -0.04000 -1.0 2.0
   60    39    42    44  -0.29050  1.0 3.0
   61    60    39    33   7.00000 -1.0 2.0
   61    60    39    42   7.00000 -1.0 2.0
   39    33    38    40  -0.28300  1.0 1.0
   39    33    38    40   0.26700 -1.0 2.0
   39    33    38    40  -0.63300  1.0 3.0
   39    33   -38    54  -0.28300  1.0 1.0
   39    33   -38    54   0.26700 -1.0 2.0
   39    33   -38    54  -0.63300  1.0 3.0
   62    59    60    61   7.00000 -1.0 2.0
   62    59    60    39   7.00000 -1.0 2.0
   55    48    54    38   0.98200  1.0 1.0
   55    48    54    38  -0.11900 -1.0 2.0
   55    48    54    38   0.24250  1.0 3.0
   55    48    54    59   0.09850  1.0 1.0
   55    48    54    59   0.15250 -1.0 2.0
   55    48    54    59  -0.50650  1.0 3.0
   50    46    48    49   0.15000  1.0 3.0
   50    46    48    54   0.34400  1.0 1.0
   50    46    48    54   0.09450 -1.0 2.0
   50    46    48    54   0.11100  1.0 3.0
   50    46    48    55   0.56750  1.0 1.0
   50    46    48    55  -0.07550 -1.0 2.0
   50    46    48    55   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
   36    30    35    37  10.50000 -1.0 2.0
   33    54    38    40   1.10000 -1.0 2.0
   45    41    40    38   1.10000 -1.0 2.0
   38    48    54    59   1.10000 -1.0 2.0
   60    62    59    54   1.10000 -1.0 2.0
   59    61    60    39   1.10000 -1.0 2.0
   33    42    39    60   1.10000 -1.0 2.0
   43    39    42    44  10.50000 -1.0 2.0
END
