* LIGAND DATABASE FILE (OPLS2005)
*
001      67    69    121    187     351
    1     0 S   NP   _N1_     1    32.36452    98.01431   -19.12468
    2     1 S   H    _HN1     2     1.03891   128.62772    35.96787
    3     1 S   H    _H1_     3     1.03289   116.71631  -112.29347
    4     1 S   H    _H2_     4     1.02822    84.69043   141.65280
    5     1 S   CT   _CA1     5     1.49483    25.96501   -25.55024
    6     5 S   HC   _HA1     6     1.09694   105.28568    85.04001
    7     5 S   CO3  _C1_     7     1.54698   112.25809   -29.92313
    8     7 S   O2Z  _O11     8     1.26193   116.71976  -140.92390
    9     7 S   O2Z  _O12     9     1.26678   114.21706    40.08400
   10     5 S   CT   _CB1    10     1.53428   109.14700  -157.40518
   11    10 S   HC   HB11    11     1.09781   109.60720    61.40806
   12    10 S   HC   HB12    12     1.09790   108.46594   176.48721
   13    10 S   CT   _CG1    13     1.53138   114.39274   -64.31858
   14    13 S   HC   HG11    14     1.09765   109.34884  -125.21876
   15    13 S   HC   HG12    15     1.09273   112.46598    -8.04052
   16    13 S   C    _CD1    16     1.51398   111.76613   117.45619
   17    16 S   O    _OE1    17     1.22989   121.39805    74.14644
   18    16 S   N    _N2_    18     1.38059   113.70329  -105.82786
   19    18 S   H    _HN2    19     1.02193   119.90262     4.37524
   20    18 S   CT1  _CA2    20     1.46028   122.67563  -177.82813
   21    20 S   HC   _HA2    21     1.09702   108.45810    29.00927
   22    20 S   C    _C2_    22     1.52851   108.12942   -87.55718
   23    22 S   O    _O2_    23     1.23073   121.14042   140.39889
   24    20 S   CT   _CB2    32     1.53348   112.35554   151.64677
   25    24 S   HC   HB21    33     1.09181   110.43309    67.02482
   26    24 S   HC   HB22    34     1.09561   109.95556  -175.50952
   27    22 S   N    _N3_    24     1.38401   113.96998   -46.42892
   28    27 S   H    _HN3    25     1.02095   118.78381     2.34585
   29    24 S   S    _SG2    35     1.82420   111.27431   -55.52082
   30    27 S   CT   _CA3    26     1.45282   123.53643   178.76615
   31    30 S   HC   HA31    27     1.09519   109.10115    27.72487
   32    30 S   HC   HA32    28     1.09481   107.15638   144.91126
   33    29 S   CT   _C11    36     1.82538   100.29746   150.14645
   34    33 S   HC   _H5_    37     1.09801   107.96008    62.27426
   35    30 S   CO3  _C3_    29     1.52999   113.36364   -95.41155
   36    35 S   O2Z  _O31    30     1.26433   115.71166   -35.16105
   37    35 S   O2Z  _O32    31     1.26418   114.78838   145.77621
   38    33 S   CT   _C10    38     1.53474   117.79776   -61.28259
   39    38 S   HC   _H4_    39     1.09754   111.55416    81.84880
   40    38 S   CO   _C9_    40     1.53852    99.39738  -161.27366
   41    40 S   HC   _H3_    41     1.09819   108.99215   -81.70741
   42    38 S   OS   _O35    64     1.42974   109.88854   -42.99708
   43    40 S   N*   _N6_    42     1.44585   117.61334   156.60653
   44    40 S   OS   _O33    56     1.43826   107.80776    32.04095
   45    42 S   PR   _P1_    65     1.62509   117.81179   150.00838
   46    45 S   OM   _O37    66     1.63824    97.98167  -172.10763
   47    45 S   OM   _O36    67     1.63923    98.84826   -74.00129
   48    43 S   CRAB _C8_    43     1.37152   124.56643    94.30957
   49    48 S   HA   _H8_    44     1.08178   122.44623    -0.50358
   50    33 S   CT   _C12    57     1.53221   110.99063  -178.12195
   51    50 S   HC   _H6_    58     1.09776   112.05614    46.86279
   52    48 S   NNA  _N7_    45     1.31561   112.14550   179.59700
   53    50 S   CT   _C13    59     1.52514   113.94098   -79.10403
   54    53 S   HC   _H9_    60     1.09359   111.59673    54.58040
   55    53 S   HC   _H10    61     1.09492   110.97177   -67.77394
   56    52 S   C56B _C6_    46     1.37554   104.93406     0.29409
   57    53 S   OH   _O34    62     1.42464   109.17765   173.64455
   58    57 S   HO   _H11    63     0.97220   107.06258   179.03571
   59    43 S   C56A _C7_    47     1.36942   128.27394   -86.17283
   60    59 S   NB   _N5_    48     1.34222   128.21276     0.73302
   61    60 S   CQ   _C4_    49     1.34576   110.89205   179.10038
   62    61 S   HA   _H7_    50     1.08473   115.74641  -179.61794
   63    61 S   NB   _N4_    51     1.35341   128.66019     0.46855
   64    56 S   CA   _C5_    52     1.40387   131.55011   179.50901
   65    64 S   NND  _N8_    53     1.38154   122.18667     0.11014
   66    65 S   H    _H12    54     1.01072   120.32417    -0.54104
   67    65 S   H    _H13    55     1.01001   119.31236  -179.46661
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  15   8   2   1   1  14   7  14   6   6  10   8   2   1   1   6
   3   6   4   6   4   3   2   8   1   1   6   4   4   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    50    51    53    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    43    44    50    51    53    54    55    57    42    45  
   38    39    40    44    50    51    53    42  
   36    37  
   37  
    0  
   39    40    41    43    48    59    44    50    51    53    42    45    46    47  
   40    41    43    44    50    42    45  
   41    43    48    49    52    56    59    60    44    50    51    53    42    45  
   43    48    59    44    50    42  
   45    46    47    43    44    50  
   48    49    52    56    59    60    61    64    44    50  
   50    51    53    54    55    57    48    59  
   46    47  
   47  
    0  
   49    52    56    59    60    64  
   52    56    59  
   51    53    54    55    57    58  
   53    54    55    57  
   56    59    60    63    64    65  
   54    55    57    58  
   55    57    58  
   57    58  
   59    60    61    63    64    65    66    67  
   58  
    0  
   60    61    62    63    64    65  
   61    62    63    64  
   62    63    64    65  
   63    64  
   64    65    66    67  
   65    66    67  
   66    67  
   67  
    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   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   42   2.9000   0.1400  -1.312500   1.7660   1.5600   0.020110767  -0.896042159
   43   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.7400   0.2000   0.937500   2.1070   1.8700   0.005000000   0.000000000
   46   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   47   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   48   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   53   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   61   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   63   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   64   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   65   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   66   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   67   0.5000   0.0300   0.370000   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   268.000  1.529
   33    50   268.000  1.529
   38    39   340.000  1.090
   38    40   250.000  1.527
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    43   275.000  1.479
   40    44   320.000  1.380
   43    48   440.000  1.371
   43    59   436.000  1.374
   48    49   367.000  1.080
   48    52   529.000  1.304
   52    56   414.000  1.391
   56    59   447.000  1.419
   56    64   469.000  1.404
   59    60   461.000  1.354
   60    61   502.000  1.324
   61    62   367.000  1.080
   61    63   502.000  1.324
   63    64   483.000  1.339
   64    65   481.000  1.340
   65    66   434.000  1.010
   65    67   434.000  1.010
   44    50   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    57   320.000  1.410
   57    58   553.000  0.945
   42    45   325.000  1.672
   45    46   325.000  1.672
   45    47   325.000  1.672
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  111.63000
   29    33    50    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    75.00000  109.43000
   33    38    42    50.00000  109.50000
   33    50    44    50.00000  109.50000
   33    50    51    37.50000  110.70000
   33    50    53    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    45.00000  112.01100
   38    40    43    75.00000  107.44000
   38    40    44    90.00000  108.56700
   38    42    45   100.00000  120.50000
   40    38    39    45.00000  108.72000
   40    43    48    70.00000  128.80000
   40    43    59    70.00000  125.80000
   40    44    50    60.00000  109.50000
   43    40    41    55.00000  103.44000
   43    48    49    35.00000  123.05000
   43    48    52    70.00000  113.90000
   43    59    56    70.00000  106.20000
   43    59    60    70.00000  126.20000
   48    52    56    70.00000  103.80000
   52    48    49    35.00000  123.05000
   52    56    59    70.00000  110.40000
   52    56    64    70.00000  132.40000
   56    59    60    70.00000  127.70000
   56    64    63    70.00000  117.30000
   56    64    65    70.00000  123.50000
   59    43    48    70.00000  105.40000
   59    60    61    70.00000  111.00000
   60    61    62    35.00000  115.45000
   60    61    63    70.00000  129.10000
   61    63    64    70.00000  118.60000
   63    61    62    35.00000  115.45000
   63    64    65    70.00000  119.30000
   64    56    59    85.00000  116.20000
   64    65    66    35.00000  120.00000
   64    65    67    35.00000  120.00000
   67    65    66    35.00000  120.00000
   44    40    41    35.00000  109.50000
   44    40    43   105.00000  106.22000
   44    50    51    35.00000  109.50000
   44    50    53    50.00000  109.50000
   50    33    34    37.50000  110.70000
   50    33    38    58.35000  112.70000
   50    53    54    37.50000  110.70000
   50    53    55    37.50000  110.70000
   50    53    57    50.00000  109.50000
   53    50    51    37.50000  110.70000
   53    57    58    55.00000  108.50000
   55    53    54    33.00000  107.80000
   57    53    54    35.00000  109.50000
   57    53    55    35.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  109.38000
   42    45    46    45.00000  102.60000
   42    45    47    45.00000  102.60000
   47    45    46    35.00000   94.00000
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    50    44   0.56750  1.0 1.0
   29    33    50    44  -0.07550 -1.0 2.0
   29    33    50    44   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    53   0.44750  1.0 1.0
   29    33    50    53  -0.17800 -1.0 2.0
   29    33    50    53   0.20200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    43  -0.64600  1.0 1.0
   33    38    40    43   0.58400 -1.0 2.0
   33    38   -40    44   0.62750  1.0 1.0
   33    38   -40    44  -0.30950 -1.0 2.0
   33    38   -40    44   0.27300  1.0 3.0
   33    38    42    45  -2.65550  1.0 1.0
   33    38    42    45  -0.22350 -1.0 2.0
   33    38    42    45   0.24150  1.0 3.0
   33    50    53    54   0.15000  1.0 3.0
   33    50    53    55   0.15000  1.0 3.0
   33    50    53    57   0.86500  1.0 1.0
   33    50    53    57  -0.17500 -1.0 2.0
   33    50    53    57   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    50    44   0.23400  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    53   0.15000  1.0 3.0
   38    33   -50    44   0.62750  1.0 1.0
   38    33   -50    44  -0.30950 -1.0 2.0
   38    33   -50    44   0.27300  1.0 3.0
   38    33    50    51   0.15000  1.0 3.0
   38    33    50    53   0.56750  1.0 1.0
   38    33    50    53  -0.07550 -1.0 2.0
   38    33    50    53   0.20000  1.0 3.0
   38    40    43    48   1.10250  1.0 1.0
   38    40    43    48   0.01650 -1.0 2.0
   38    40    43    48   0.39100  1.0 3.0
   38    40    43    59   1.10250  1.0 1.0
   38    40    43    59   0.01650 -1.0 2.0
   38    40    43    59   0.39100  1.0 3.0
   38    40   -44    50   0.06250  1.0 1.0
   38    40   -44    50  -0.01100 -1.0 2.0
   38    40   -44    50   0.28050  1.0 3.0
   38    42    45    46   0.05050  1.0 1.0
   38    42    45    46  -1.30700 -1.0 2.0
   38    42    45    46   0.91550  1.0 3.0
   38    42    45    47   0.05050  1.0 1.0
   38    42    45    47  -1.30700 -1.0 2.0
   38    42    45    47   0.91550  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    43   0.15000  1.0 3.0
   39    38    40    44   0.23400  1.0 3.0
   39    38    42    45   0.03000  1.0 3.0
   40    38    42    45  -2.65550  1.0 1.0
   40    38    42    45  -0.22350 -1.0 2.0
   40    38    42    45   0.24150  1.0 3.0
   40    43    48    49   3.62500 -1.0 2.0
   40    43    48    52   3.62500 -1.0 2.0
   40    43    59    56   0.81400  1.0 1.0
   40    43    59    56   1.55550 -1.0 2.0
   40    43    59    60   3.62500 -1.0 2.0
   40    44   -50    33   0.06250  1.0 1.0
   40    44   -50    33  -0.01100 -1.0 2.0
   40    44   -50    33   0.28050  1.0 3.0
   40    44    50    51   0.37050  1.0 3.0
   40    44    50    53   0.06250  1.0 1.0
   40    44    50    53  -0.01100 -1.0 2.0
   40    44    50    53   0.28050  1.0 3.0
   41    40    43    48   0.00000  1.0 1.0
   41    40    43    59   0.00000  1.0 1.0
   41    40    44    50   0.37050  1.0 3.0
   43    40    44    50  -2.37750  1.0 1.0
   43    40    44    50  -0.08150 -1.0 2.0
   43    40    44    50   0.59000  1.0 3.0
   43    48   -52    56   3.62500 -1.0 2.0
   43    59    60    61   3.62500 -1.0 2.0
   48    43   -59    56   0.70250  1.0 1.0
   48    43   -59    56   1.56150 -1.0 2.0
   48    43    59    60   3.62500 -1.0 2.0
   48    52   -56    59   3.62500 -1.0 2.0
   48    52    56    64   3.62500 -1.0 2.0
   49    48    52    56   3.62500 -1.0 2.0
   52    56   -59    43   3.62500 -1.0 2.0
   52    56    59    60   3.62500 -1.0 2.0
   52    56    64    63   3.62500 -1.0 2.0
   52    56    64    65   3.62500 -1.0 2.0
   56    59    60    61   3.62500 -1.0 2.0
   56    64    65    66   0.70000 -1.0 2.0
   56    64    65    67   0.70000 -1.0 2.0
   59    43    48    49   3.62500 -1.0 2.0
   59    43   -48    52   3.62500 -1.0 2.0
   59    56    64    63   3.62500 -1.0 2.0
   59    56    64    65   3.62500 -1.0 2.0
   59    60    61    62   3.62500 -1.0 2.0
   59    60   -61    63   3.62500 -1.0 2.0
   60    61    63    64   3.62500 -1.0 2.0
   61    63   -64    56   3.62500 -1.0 2.0
   61    63    64    65   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   63    64    65    66   0.70000 -1.0 2.0
   63    64    65    67   0.70000 -1.0 2.0
   64    56    59    43   3.00000 -1.0 2.0
   64    56   -59    60   3.62500 -1.0 2.0
   44    40    43    48   0.10350  1.0 1.0
   44    40    43    48  -0.15350 -1.0 2.0
   44    40    43    59   0.10350  1.0 1.0
   44    40    43    59  -0.15350 -1.0 2.0
   44    50    53    54   0.23400  1.0 3.0
   44    50    53    55   0.23400  1.0 3.0
   44    50    53    57   3.69350  1.0 1.0
   44    50    53    57  -1.82950 -1.0 2.0
   50    33    38    39   0.15000  1.0 3.0
   50    33   -38    40   3.97050  1.0 1.0
   50    33    38    42   0.62750  1.0 1.0
   50    33    38    42  -0.30950 -1.0 2.0
   50    33    38    42   0.27300  1.0 3.0
   50    53    57    58  -0.11600  1.0 1.0
   50    53    57    58  -0.09450 -1.0 2.0
   50    53    57    58   0.21250  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    57   0.23400  1.0 3.0
   54    53    57    58   0.19450  1.0 3.0
   55    53    57    58   0.19450  1.0 3.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    43  -0.86350  1.0 1.0
   42    38    40    43   0.04750 -1.0 2.0
   42    38    40    44   1.11900  1.0 1.0
   42    38    40    44  -1.16350 -1.0 2.0
   42    38    40    44  -0.34150  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
   48    59    43    40   4.00000 -1.0 2.0
   52    49    48    43   1.10000 -1.0 2.0
   59    64    56    52   4.00000 -1.0 2.0
   56    60    59    43   4.00000 -1.0 2.0
   63    62    61    60   1.10000 -1.0 2.0
   63    65    64    56   4.00000 -1.0 2.0
   67    64    65    66   1.00000 -1.0 2.0
END
