* LIGAND DATABASE FILE (OPLS2005)
*
001      68    71    137    230     413
    1     0 S   NP   _N1_     1    28.79118    94.74728   -23.14814
    2     1 S   H    _HN1     2     1.02951    82.55402    19.55922
    3     1 S   H    _H1_     3     1.02828    28.67967   168.46406
    4     1 S   H    _H2_     4     1.02781   102.84168   -87.65543
    5     1 S   CT   _CA1     5     1.50110   135.21707   131.10551
    6     5 S   HC   _HA1     6     1.09574   105.21358    77.35221
    7     5 S   CO3  _C1_     7     1.53781   112.40604   -42.89316
    8     7 S   O2Z  _O11     8     1.26369   114.99841   -43.82348
    9     7 S   O2Z  _O12     9     1.26235   114.92911   135.30637
   10     5 S   CT   _CB1    10     1.53081   107.42547  -164.69291
   11    10 S   HC   HB11    11     1.09831   109.36061   -50.15227
   12    10 S   HC   HB12    12     1.09814   110.45228    66.44053
   13    10 S   CT   _CG1    13     1.52991   112.61019  -171.15835
   14    13 S   HC   HG11    14     1.09591   110.59237   -65.15426
   15    13 S   HC   HG12    15     1.09668   109.83654    54.08175
   16    13 S   C    _CD1    16     1.51799   112.24678   174.50638
   17    16 S   O    _OE1    17     1.22731   123.30697     4.98354
   18    16 S   N    _N2_    18     1.38648   111.65778  -175.17432
   19    18 S   H    _HN2    19     1.01595   118.93510     1.54358
   20    18 S   CT1  _CA2    20     1.46181   123.33380   177.77895
   21    20 S   HC   _HA2    21     1.09737   109.41443    -2.23791
   22    20 S   C    _C2_    22     1.53479   108.49101  -117.70104
   23    22 S   O    _O2_    23     1.23045   122.28847  -147.79918
   24    20 S   CT   _CB2    32     1.53406   111.54270   119.85573
   25    24 S   HC   HB21    33     1.09406   109.72090    56.95528
   26    24 S   HC   HB22    34     1.09485   109.77317   175.50198
   27    22 S   N    _N3_    24     1.38330   113.59785    39.64269
   28    27 S   H    _HN3    25     1.01613   119.55117    -3.51758
   29    24 S   S    _SG2    35     1.83200   111.16409   -65.52293
   30    27 S   CT   _CA3    26     1.45288   123.17870   177.04494
   31    30 S   HC   HA31    27     1.09550   107.52071   -64.14551
   32    30 S   HC   HA32    28     1.09557   107.96571    52.28153
   33    29 S   CT   _C14    36     1.86305   102.33886   162.03374
   34    30 S   CO3  _C3_    29     1.52950   114.09512   174.26301
   35    34 S   O2Z  _O31    30     1.26373   116.05536    -0.87982
   36    34 S   O2Z  _O32    31     1.26427   114.41451   179.18147
   37    33 S   CM   _C13    37     1.51600   109.70638    54.74719
   38    37 S   HC   _H17    38     1.08597   119.72790   -57.91840
   39    33 S   CT   _C15    66     1.52995   109.14988   -71.50279
   40    39 S   HC   _H18    67     1.09547   112.44916   156.94686
   41    39 S   HC   _H19    68     1.09248   114.51443    32.13240
   42    37 S   CM   _C12    39     1.34496   121.57079   122.46565
   43    42 S   HC   _H16    40     1.08535   120.40746  -179.06497
   44    42 S   CT   _C11    41     1.50795   120.75740     3.24401
   45    44 S   HC   _H5_    42     1.09423   111.73906   160.54189
   46    44 S   CT   _C10    43     1.52224   108.77155    34.71179
   47    46 S   HC   _H14    44     1.09593   113.40624    52.34443
   48    46 S   HC   _H15    45     1.09656   112.28793   172.40917
   49    33 S   CT   _C9_    46     1.56036   111.24343   179.07974
   50    49 S   CT   _C7_    47     1.54989   116.69638   -47.45406
   51    50 S   HC   _H4_    48     1.09247   113.93004    29.84354
   52    49 S   OS   _O34    63     1.42388   105.39844    81.14617
   53    50 S   CT   _C8_    49     1.53130   114.80225   155.51573
   54    53 S   HC   _H12    50     1.09650   110.93536    49.47854
   55    53 S   HC   _H13    51     1.09659   109.85523   -67.41931
   56    52 S   CO4  _C16    64     1.36917   109.20100    25.11204
   57    56 S   O    _O33    65     1.22106   124.32972   173.59207
   58    53 S   CT   _C4_    52     1.52761   111.94030   171.36075
   59    58 S   HC   _H6_    53     1.09670   108.78207  -164.93012
   60    58 S   HC   _H7_    54     1.09693   109.77523    79.39961
   61    58 S   CT   _C5_    55     1.52867   113.30670   -42.61158
   62    61 S   HC   _H8_    56     1.09763   109.05409   106.33347
   63    61 S   HC   _H9_    57     1.09599   109.57804  -137.79117
   64    61 S   CT   _C6_    58     1.51816   112.51890   -15.12716
   65    64 S   HC   _H10    59     1.09470   111.28879   177.76402
   66    64 S   HC   _H11    60     1.09546   112.02148   -59.58638
   67    44 S   NP   _N4_    61     1.53091   111.00421   -76.47384
   68    67 S   H    _H3_    62     1.02986   107.72903   -25.55599
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  19   2   1   1  14   5   9   5   4  11   4  15   8  11   5   4
  12  15   8   4  11   6   5   1   1   9   5   4   7   5   4   4
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    46    49    50    52    56    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    46    47    48    49    50    51    53    67    52    56    57    39    40    41  
   35    36  
   36  
    0  
   38    42    43    44    45    46    49    50    67    52    56    39    40    41  
   42    43    44    49    39  
   40    41    42    46    49    50    52    56    57  
   41    49    52    56    57  
   49    52    56    57  
   43    44    45    46    47    48    49    50    64    67    68  
   44    45    46    67  
   45    46    47    48    49    50    51    53    61    64    65    66    67    68    52  
   46    47    48    49    50    64    67    68  
   47    48    49    50    51    53    64    67    68    52    56  
   48    49    50    67    52  
   49    50    67    52  
   50    51    53    54    55    58    64    67    68    52    56    57  
   51    53    54    55    58    59    60    61    64    65    66    67    68    52    56  
   53    54    55    58    64    67    68    52  
   56    57    53    67  
   54    55    58    59    60    61    62    63    64    67    68  
   55    58    59    60    61    67  
   58    59    60    61    67  
   57  
    0  
   59    60    61    62    63    64    65    66    67  
   60    61    62    63    64  
   61    62    63    64  
   62    63    64    65    66    67    68  
   63    64    65    66    67  
   64    65    66    67  
   65    66    67    68  
   66    67    68  
   67    68  
   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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   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   0.474400   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5000   0.0660  -0.014400   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   68   0.5000   0.0300   0.290000   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    49   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    42   549.000  1.340
   42    43   340.000  1.080
   42    44   317.000  1.510
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    67   367.000  1.471
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   268.000  1.529
   49    50   268.000  1.529
   49    52   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   50    67   367.000  1.471
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   367.000  1.471
   67    68   434.000  1.010
   52    56   214.000  1.327
   56    57   570.000  1.229
   56    39   317.000  1.522
   39    40   340.000  1.090
   39    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    42    70.00000  124.00000
   33    49    46    58.35000  112.70000
   33    49    50    58.35000  112.70000
   33    49    52    50.00000  109.50000
   33    39    56    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43    35.00000  120.00000
   37    42    44    70.00000  124.00000
   42    37    38    35.00000  120.00000
   42    44    45    35.00000  109.50000
   42    44    46    70.00000  112.02700
   42    44    67    75.00000  110.06800
   44    42    43    35.00000  117.00000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    49    58.35000  112.70000
   44    67    50    75.00000  113.01200
   44    67    64    75.00000  113.01200
   44    67    68    35.00000  109.50000
   46    44    45    37.50000  110.70000
   46    49    50    58.35000  112.70000
   46    49    52    50.00000  109.50000
   48    46    47    33.00000  107.80000
   49    33    37    70.00000  112.02700
   49    46    47    37.50000  110.70000
   49    46    48    37.50000  110.70000
   49    50    51    37.50000  110.70000
   49    50    53    58.35000  112.70000
   49    50    67    80.00000  111.20000
   49    52    56    83.00000  116.90000
   50    53    54    37.50000  110.70000
   50    53    55    37.50000  110.70000
   50    53    58    58.35000  112.70000
   50    67    64    75.00000  113.01200
   50    67    68    35.00000  109.50000
   53    50    51    37.50000  110.70000
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    61    58.35000  112.70000
   55    53    54    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    37.50000  110.70000
   58    61    62    37.50000  110.70000
   58    61    63    37.50000  110.70000
   58    61    64    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    37.50000  110.70000
   61    58    60    37.50000  110.70000
   61    64    65    37.50000  110.70000
   61    64    66    37.50000  110.70000
   61    64    67    80.00000  111.20000
   63    61    62    33.00000  107.80000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    67    68    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    44    45    35.00000  109.50000
   67    44    46    80.00000  111.20000
   67    50    51    35.00000  109.50000
   67    50    53    80.00000  111.20000
   67    64    65    35.00000  109.50000
   67    64    66    35.00000  109.50000
   52    49    50    50.00000  109.50000
   52    56    57    83.00000  123.40000
   52    56    39    81.00000  111.40000
   56    39    40    35.00000  109.50000
   56    39    41    35.00000  109.50000
   39    33    37    70.00000  112.02700
   39    33    49    58.35000  112.70000
   39    56    57    80.00000  120.40000
   41    39    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    49    46   0.44750  1.0 1.0
   29    33    49    46  -0.17800 -1.0 2.0
   29    33    49    46   0.20200  1.0 3.0
   29    33    49    50   0.44750  1.0 1.0
   29    33    49    50  -0.17800 -1.0 2.0
   29    33    49    50   0.20200  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    39    56   0.56750  1.0 1.0
   29    33    39    56  -0.07550 -1.0 2.0
   29    33    39    56   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    44   7.00000 -1.0 2.0
   33    49    50    51   0.15000  1.0 3.0
   33    49    50    53   0.56750  1.0 1.0
   33    49    50    53  -0.07550 -1.0 2.0
   33    49    50    53   0.20000  1.0 3.0
   33    49    50    67   1.36600  1.0 1.0
   33    49    50    67  -0.11450 -1.0 2.0
   33    49    50    67   0.24250  1.0 3.0
   33    49   -52    56  -0.25900  1.0 1.0
   33    49   -52    56  -0.47000 -1.0 2.0
   33    49   -52    56   0.11750  1.0 3.0
   37    33    49    46   0.34400  1.0 1.0
   37    33    49    46   0.09450 -1.0 2.0
   37    33    49    46   0.11100  1.0 3.0
   37    33    49    50   0.34400  1.0 1.0
   37    33    49    50   0.09450 -1.0 2.0
   37    33    49    50   0.11100  1.0 3.0
   37    33    49    52   0.61850  1.0 1.0
   37    33    49    52  -0.22750 -1.0 2.0
   37    33    49    52   0.15300  1.0 3.0
   37    33    39    56  -0.98800  1.0 1.0
   37    33    39    56   0.48800 -1.0 2.0
   37    33    39    56   0.76800  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    42    44    45   0.00000  1.0 1.0
   37    42   -44    46   0.09850  1.0 1.0
   37    42   -44    46   0.15250 -1.0 2.0
   37    42   -44    46  -0.50650  1.0 3.0
   37    42    44    67   0.80850  1.0 1.0
   37    42    44    67  -0.47300 -1.0 2.0
   37    42    44    67  -0.52300  1.0 3.0
   38    37    42    43   7.00000 -1.0 2.0
   38    37    42    44   7.00000 -1.0 2.0
   42    44    46    47   0.15000  1.0 3.0
   42    44    46    48   0.15000  1.0 3.0
   42    44    46    49   0.34400  1.0 1.0
   42    44    46    49   0.09450 -1.0 2.0
   42    44    46    49   0.11100  1.0 3.0
   42    44    67    50   0.08000 -1.0 2.0
   42    44    67    64   0.08000 -1.0 2.0
   42    44    67    68   0.17350  1.0 3.0
   43    42    44    45   0.33100  1.0 3.0
   43    42    44    46   0.00000  1.0 1.0
   43    42    44    67   0.00000  1.0 1.0
   44    46   -49    33   0.56750  1.0 1.0
   44    46   -49    33  -0.07550 -1.0 2.0
   44    46   -49    33   0.20000  1.0 3.0
   44    46   -49    50   0.56750  1.0 1.0
   44    46   -49    50  -0.07550 -1.0 2.0
   44    46   -49    50   0.20000  1.0 3.0
   44    46    49    52   0.62750  1.0 1.0
   44    46    49    52  -0.30950 -1.0 2.0
   44    46    49    52   0.27300  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    49   0.15000  1.0 3.0
   45    44    67    50   0.15000  1.0 3.0
   45    44    67    64   0.15000  1.0 3.0
   45    44    67    68   0.13050  1.0 3.0
   46    44   -67    50   0.47100  1.0 1.0
   46    44    67    64   0.47100  1.0 1.0
   46    44    67    68   0.17350  1.0 3.0
   46    49    50    51   0.15000  1.0 3.0
   46    49    50    53   0.56750  1.0 1.0
   46    49    50    53  -0.07550 -1.0 2.0
   46    49    50    53   0.20000  1.0 3.0
   46    49   -50    67   1.36600  1.0 1.0
   46    49   -50    67  -0.11450 -1.0 2.0
   46    49   -50    67   0.24250  1.0 3.0
   46    49    52    56  -0.25900  1.0 1.0
   46    49    52    56  -0.47000 -1.0 2.0
   46    49    52    56   0.11750  1.0 3.0
   47    46    49    33   0.15000  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    52   0.23400  1.0 3.0
   48    46    49    33   0.15000  1.0 3.0
   48    46    49    50   0.15000  1.0 3.0
   48    46    49    52   0.23400  1.0 3.0
   49    33    37    38   0.00000  1.0 1.0
   49    33   -37    42   0.09850  1.0 1.0
   49    33   -37    42   0.15250 -1.0 2.0
   49    33   -37    42  -0.50650  1.0 3.0
   49    33   -39    56  -0.95700  1.0 1.0
   49    33   -39    56  -0.18200 -1.0 2.0
   49    33   -39    56   0.29450  1.0 3.0
   49    33    39    40   0.15000  1.0 3.0
   49    33    39    41   0.15000  1.0 3.0
   49    50    53    54   0.15000  1.0 3.0
   49    50    53    55   0.15000  1.0 3.0
   49    50    53    58   0.56750  1.0 1.0
   49    50    53    58  -0.07550 -1.0 2.0
   49    50    53    58   0.20000  1.0 3.0
   49    50   -67    44   0.47100  1.0 1.0
   49    50    67    64   0.47100  1.0 1.0
   49    50    67    68   0.17350  1.0 3.0
   49    52    56    57   3.00000 -1.0 2.0
   49    52   -56    39   1.63150  1.0 1.0
   49    52   -56    39   2.92000 -1.0 2.0
   50    49    52    56  -0.25900  1.0 1.0
   50    49    52    56  -0.47000 -1.0 2.0
   50    49    52    56   0.11750  1.0 3.0
   50    53    58    59   0.15000  1.0 3.0
   50    53    58    60   0.15000  1.0 3.0
   50    53    58    61   0.56750  1.0 1.0
   50    53    58    61  -0.07550 -1.0 2.0
   50    53    58    61   0.20000  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    55   0.15000  1.0 3.0
   51    50    53    58   0.15000  1.0 3.0
   51    50    67    44   0.15000  1.0 3.0
   51    50    67    64   0.15000  1.0 3.0
   51    50    67    68   0.13050  1.0 3.0
   53    50    67    44   0.47100  1.0 1.0
   53    50    67    64   0.47100  1.0 1.0
   53    50    67    68   0.17350  1.0 3.0
   53    58    61    62   0.15000  1.0 3.0
   53    58    61    63   0.15000  1.0 3.0
   53    58   -61    64   0.56750  1.0 1.0
   53    58   -61    64  -0.07550 -1.0 2.0
   53    58   -61    64   0.20000  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    61   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    61   0.15000  1.0 3.0
   58    61    64    65   0.15000  1.0 3.0
   58    61    64    66   0.15000  1.0 3.0
   58    61    64    67   1.36600  1.0 1.0
   58    61    64    67  -0.11450 -1.0 2.0
   58    61    64    67   0.24250  1.0 3.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    63   0.15000  1.0 3.0
   59    58    61    64   0.15000  1.0 3.0
   60    58    61    62   0.15000  1.0 3.0
   60    58    61    63   0.15000  1.0 3.0
   60    58    61    64   0.15000  1.0 3.0
   61    64    67    44   0.47100  1.0 1.0
   61    64   -67    50   0.47100  1.0 1.0
   61    64    67    68   0.17350  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    67   0.19200  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   63    61    64    67   0.19200  1.0 3.0
   65    64    67    44   0.15000  1.0 3.0
   65    64    67    50   0.15000  1.0 3.0
   65    64    67    68   0.13050  1.0 3.0
   66    64    67    44   0.15000  1.0 3.0
   66    64    67    50   0.15000  1.0 3.0
   66    64    67    68   0.13050  1.0 3.0
   67    44    46    47   0.19200  1.0 3.0
   67    44    46    48   0.19200  1.0 3.0
   67    44   -46    49   1.36600  1.0 1.0
   67    44   -46    49  -0.11450 -1.0 2.0
   67    44   -46    49   0.24250  1.0 3.0
   67    50    53    54   0.19200  1.0 3.0
   67    50    53    55   0.19200  1.0 3.0
   67    50   -53    58   1.36600  1.0 1.0
   67    50   -53    58  -0.11450 -1.0 2.0
   67    50   -53    58   0.24250  1.0 3.0
   52    49    50    51   0.23400  1.0 3.0
   52    49    50    53   0.62750  1.0 1.0
   52    49    50    53  -0.30950 -1.0 2.0
   52    49    50    53   0.27300  1.0 3.0
   52    49    50    67   1.69300  1.0 1.0
   52    49    50    67  -0.48450 -1.0 2.0
   52    56   -39    33   0.36750  1.0 3.0
   52    56    39    40   0.00000  1.0 1.0
   52    56    39    41   0.00000  1.0 1.0
   57    56    39    33   0.30150 -1.0 2.0
   57    56    39    40   0.00000  1.0 1.0
   57    56    39    41   0.00000  1.0 1.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    42   0.09850  1.0 1.0
   39    33    37    42   0.15250 -1.0 2.0
   39    33    37    42  -0.50650  1.0 3.0
   39    33    49    46   0.56750  1.0 1.0
   39    33    49    46  -0.07550 -1.0 2.0
   39    33    49    46   0.20000  1.0 3.0
   39    33    49    50   0.56750  1.0 1.0
   39    33    49    50  -0.07550 -1.0 2.0
   39    33    49    50   0.20000  1.0 3.0
   39    33   -49    52   0.62750  1.0 1.0
   39    33   -49    52  -0.30950 -1.0 2.0
   39    33   -49    52   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    38    37    42   1.10000 -1.0 2.0
   44    43    42    37   1.10000 -1.0 2.0
   52    39    56    57  10.50000 -1.0 2.0
END
