* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    122    186     350
    1     0 S   NP   _N1_     1    31.25775   100.16091   -21.48855
    2     1 S   H    _HN1     2     1.03475   166.13201  -130.65419
    3     1 S   H    _H1_     3     1.02852    59.73883  -102.25413
    4     1 S   H    _H2_     4     1.02733    72.89706   135.02617
    5     1 S   CT   _CA1     5     1.50145    79.79940    19.14255
    6     5 S   HC   _HA1     6     1.09531   104.96429   124.45464
    7     5 S   CO3  _C1_     7     1.53754   113.25244     3.75895
    8     7 S   O2Z  _O11     8     1.26438   115.06530   -30.03724
    9     7 S   O2Z  _O12     9     1.26237   115.15516   149.44378
   10     5 S   CT   _CB1    10     1.53003   107.37899  -117.02395
   11    10 S   HC   HB11    11     1.09566   109.35357   -39.95727
   12    10 S   HC   HB12    12     1.09835   110.40851    75.58459
   13    10 S   CT   _CG1    13     1.53293   113.02347  -162.60012
   14    13 S   HC   HG11    14     1.09542   110.83617   -95.76446
   15    13 S   HC   HG12    15     1.09627   111.71029    23.66247
   16    13 S   C    _CD1    16     1.51493   109.59953   143.86863
   17    16 S   O    _OE1    17     1.22762   122.20306    96.62218
   18    16 S   N    _N2_    18     1.38443   112.20672   -80.56513
   19    18 S   H    _HN2    19     1.01928   118.81339    -4.59175
   20    18 S   CT1  _CA2    20     1.45942   123.34491   172.66685
   21    20 S   HC   _HA2    21     1.09675   108.79177    30.16479
   22    20 S   C    _C2_    22     1.53254   108.73675   -86.62844
   23    22 S   O    _O2_    23     1.23110   121.11305   152.44573
   24    20 S   CT   _CB2    32     1.53279   111.64677   153.68571
   25    24 S   HC   HB21    33     1.09273   109.51057    59.23256
   26    24 S   HC   HB22    34     1.09542   110.09870   177.07524
   27    22 S   N    _N3_    24     1.38375   114.39464   -35.14561
   28    27 S   H    _HN3    25     1.01578   119.36924     2.79904
   29    24 S   S    _SG2    35     1.82792   111.04054   -63.28844
   30    27 S   CT   _CA3    26     1.45278   123.31709  -177.49908
   31    30 S   HC   HA31    27     1.09558   108.18842   -46.12438
   32    30 S   HC   HA32    28     1.09546   107.24954    70.25410
   33    29 S   CT   _C6_    36     1.87311   101.96972   150.78485
   34    30 S   CO3  _C3_    29     1.53047   114.37208  -168.30336
   35    34 S   O2Z  _O31    30     1.26433   116.35265     2.36629
   36    34 S   O2Z  _O32    31     1.26426   114.40607  -177.87072
   37    33 S   CT   _C7_    37     1.55949   104.64335   178.02107
   38    37 S   HC   _H11    38     1.09575   111.03532   -58.00401
   39    37 S   HC   _H12    39     1.09561   111.33493    59.94809
   40    33 S   CT   _C5_    59     1.56561   109.45031    58.18050
   41    40 S   HC   _H9_    60     1.09705   109.77775  -177.67729
   42    40 S   HC   _H10    61     1.09723   109.82152   -63.29988
   43    37 S   S    _S1_    40     1.83321   114.67197  -178.48418
   44    40 S   CT   _C4_    62     1.52666   116.86822    59.99433
   45    44 S   HC   _H6_    63     1.09306   112.24266   -60.50382
   46    44 S   HC   _H7_    64     1.09548   109.49310  -179.45070
   47    44 S   HC   _H8_    65     1.09322   111.81987    61.93816
   48    43 S   C4T  _C8_    41     1.82151    96.18145   -58.52522
   49    48 S   HC   _H3_    42     1.09549   113.54998   -76.56875
   50    48 S   C4T  _C9_    43     1.55769   118.92206   146.40108
   51    50 S   HC   _H4_    44     1.09598   113.26809   134.43729
   52    48 S   N4   _N4_    47     1.45589   109.06118    49.34589
   53    50 S   C4   _C10    45     1.55460    85.21348  -111.61407
   54    53 S   O    _O33    46     1.20931   136.74270  -179.42054
   55    33 S   CT1  _C11    48     1.56739   111.24890   -62.27618
   56    55 S   HC   _H5_    49     1.09844   108.62412    81.63134
   57    50 S   NT   _N5_    53     1.46883   112.70137     1.53161
   58    57 S   H    _H13    54     1.01986   113.18046    58.33519
   59    55 S   CO3  _C12    50     1.55045   117.05404   -38.17674
   60    59 S   O2Z  _O35    51     1.26231   116.16345   -64.56143
   61    59 S   O2Z  _O34    52     1.26628   114.67008   115.43938
   62    57 S   CT   _C13    55     1.45741   109.74695  -179.66662
   63    62 S   HC   _H14    56     1.09454   111.65203    60.04038
   64    62 S   HC   _H15    57     1.09497   111.45174   -62.15331
   65    62 S   HC   _H16    58     1.09449   109.35205   178.67588
  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  13   5   4   3
  19   2   1   1  14   5   4  11   6   5   8   4   2   1   1  12
   6  11   6   8   7   2   4   3   5   4   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    55    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    52    55    56    59    40    41    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    48    53    52    55    56    59    60    61    40    41    42    44    45    46    47  
   35    36  
   36  
    0  
   38    39    43    48    49    50    52    55    56    59    40    41    42    44  
   39    43    48    55    40  
   43    48    55    40  
   41    42    44    45    46    47    43    52    55    56    59  
   42    44    45    46    47    55  
   44    45    46    47    55  
   48    49    50    51    53    52    55    57  
   45    46    47    55  
   46    47  
   47  
    0  
   49    50    51    53    54    52    55    56    59    57    58    62  
   50    51    53    52    55    57  
   51    53    54    52    55    57    58    62    63    64    65  
   53    54    52    57    58    62  
   55    56    59    60    61    57    53    54  
   54    55    56    59    57    58    62  
   55    57  
   56    59    60    61  
   59    60    61  
   58    62    63    64    65  
   62    63    64    65  
   60    61  
   61  
    0  
   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  -0.335000   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   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   53   3.7500   0.1050   0.629000   1.9250   1.7000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   55   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.3000   0.1700  -0.702500   2.1120   1.8750   0.051222218  -2.220205820
   58   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   3.5000   0.0660   0.020000   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    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   268.000  1.529
   33    55   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   222.000  1.810
   43    48   200.000  1.824
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   305.000  1.456
   50    51   340.000  1.090
   50    53   250.000  1.540
   50    57   305.000  1.456
   53    54   930.000  1.212
   53    52   440.000  1.369
   52    55   337.000  1.449
   55    56   340.000  1.090
   55    59   317.000  1.522
   59    60   656.000  1.250
   59    61   656.000  1.250
   57    58   434.000  1.010
   57    62   382.000  1.448
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   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  111.63000
   29    33    55    75.00000  108.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    75.00000  111.63000
   33    55    52    80.00000  109.70000
   33    55    56    37.50000  110.70000
   33    55    59    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    44    58.35000  112.70000
   37    43    48    85.00000   99.86700
   39    37    38    33.00000  107.80000
   43    37    38    35.00000  109.50000
   43    37    39    35.00000  109.50000
   43    48    49    45.00000  109.41400
   43    48    50    65.00000  119.05700
   43    48    52    80.00000  108.62000
   48    50    51    37.50000  110.70000
   48    50    53   100.00000   86.36000
   48    50    57    65.00000  120.10000
   48    52    53   100.00000   93.00000
   48    52    55    50.00000  132.70000
   50    48    49    37.50000  110.70000
   50    53    54    60.00000  136.58000
   50    53    52    95.00000   92.72400
   50    57    58    50.00000  110.07900
   50    57    62    51.80000  107.20000
   53    50    51    40.00000  113.37500
   53    52    55    50.00000  132.10000
   52    48    49    50.00000  112.01000
   52    48    50   105.00000   87.49700
   52    53    54    75.00000  131.60000
   52    55    56    35.00000  109.50000
   52    55    59    63.00000  110.10000
   55    33    37    58.35000  112.70000
   55    59    60    70.00000  117.00000
   55    59    61    70.00000  117.00000
   59    55    56    35.00000  109.50000
   61    59    60    80.00000  126.00000
   57    50    51    50.00000  107.60000
   57    50    53    80.00000  109.96600
   57    62    63    35.00000  109.50000
   57    62    64    35.00000  109.50000
   57    62    65    35.00000  109.50000
   62    57    58    35.00000  109.50000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    55    58.35000  112.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   42    40    41    33.00000  107.80000
   44    40    41    37.50000  110.70000
   44    40    42    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.56750  1.0 1.0
   29    33    37    43  -0.07550 -1.0 2.0
   29    33    37    43   0.20000  1.0 3.0
   29    33    55    52   0.71400  1.0 1.0
   29    33    55    52   0.04300 -1.0 2.0
   29    33    55    52   0.01450  1.0 3.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    59  -2.17200  1.0 1.0
   29    33    55    59  -0.85700 -1.0 2.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    37    43    48  -0.25000 -1.0 2.0
   33    37    43    48  -0.01800  1.0 3.0
   33    55    59    60   0.00000  1.0 1.0
   33    55    59    61   0.00000  1.0 1.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    47   0.15000  1.0 3.0
   37    33    55    52   0.42250  1.0 1.0
   37    33    55    52  -0.48100 -1.0 2.0
   37    33    55    52   0.35650  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    59  -0.84850  1.0 1.0
   37    33    55    59  -0.22800 -1.0 2.0
   37    33    55    59   0.29250  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    44   0.56750  1.0 1.0
   37    33    40    44  -0.07550 -1.0 2.0
   37    33    40    44   0.20000  1.0 3.0
   37    43    48    49   0.00000  1.0 1.0
   37    43    48    50   0.25150  1.0 1.0
   37    43    48    50  -1.17200 -1.0 2.0
   37    43    48    50   0.53050  1.0 3.0
   37    43   -48    52   0.01700  1.0 1.0
   37    43   -48    52  -0.23550 -1.0 2.0
   37    43   -48    52   0.21350  1.0 3.0
   38    37    43    48   0.32350  1.0 3.0
   39    37    43    48   0.32350  1.0 3.0
   43    48    50    51   0.00000  1.0 1.0
   43    48    50    53   0.00000  1.0 1.0
   43    48    50    57   0.00000  1.0 1.0
   43    48   -52    53   0.00000  1.0 1.0
   43    48    52    55   0.00000  1.0 1.0
   48    50    53    54  -0.11250  1.0 1.0
   48    50    53    54   0.11400 -1.0 2.0
   48    50    53    54  -0.28950  1.0 3.0
   48    50   -53    52   3.00000 -1.0 2.0
   48    50    57    58  -0.05950  1.0 1.0
   48    50    57    58   0.08850 -1.0 2.0
   48    50    57    58   0.11750  1.0 3.0
   48    50    57    62   0.23450  1.0 1.0
   48    50    57    62   0.02050 -1.0 2.0
   48    50    57    62   0.25250  1.0 3.0
   48    52   -55    33   0.00000  1.0 1.0
   48    52    55    56   0.00000  1.0 1.0
   48    52    55    59   0.00000  1.0 1.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    53   0.15000  1.0 3.0
   49    48    50    57   0.15000  1.0 3.0
   49    48   -52    53   0.00000  1.0 1.0
   49    48    52    55   0.00000  1.0 1.0
   50    48   -52    53   0.00000  1.0 1.0
   50    48    52    55   0.00000  1.0 1.0
   50    53   -52    48   3.00000 -1.0 2.0
   50    53   -52    55   3.00000 -1.0 2.0
   50    57    62    63   0.28000  1.0 3.0
   50    57    62    64   0.28000  1.0 3.0
   50    57    62    65   0.28000  1.0 3.0
   51    50    53    54   0.00000  1.0 1.0
   51    50    53    52   0.00000  1.0 1.0
   51    50    57    58   0.20000  1.0 3.0
   51    50    57    62   0.28000  1.0 3.0
   53    50    57    58   0.21900  1.0 1.0
   53    50    57    58  -0.24900 -1.0 2.0
   53    50    57    58   0.15200  1.0 3.0
   53    50    57    62  -1.76800  1.0 1.0
   53    50    57    62   1.02600 -1.0 2.0
   53    50    57    62   0.19700  1.0 3.0
   53    52    55    33   0.00000  1.0 1.0
   53    52    55    56   0.00000  1.0 1.0
   53    52    55    59   0.00000  1.0 1.0
   54    53   -52    48   3.00000 -1.0 2.0
   54    53    52    55   3.00000 -1.0 2.0
   52    48   -50    51   0.15000  1.0 3.0
   52    48   -50    53   3.00000 -1.0 2.0
   52    48    50    57   2.65250  1.0 1.0
   52    48    50    57   0.86150 -1.0 2.0
   52    55    59    60   0.00000  1.0 1.0
   52    55    59    61   0.00000  1.0 1.0
   55    33    37    38   0.15000  1.0 3.0
   55    33    37    39   0.15000  1.0 3.0
   55    33   -37    43   0.44750  1.0 1.0
   55    33   -37    43  -0.17800 -1.0 2.0
   55    33   -37    43   0.20200  1.0 3.0
   55    33    40    41   0.15000  1.0 3.0
   55    33    40    42   0.15000  1.0 3.0
   55    33    40    44   0.56750  1.0 1.0
   55    33    40    44  -0.07550 -1.0 2.0
   55    33    40    44   0.20000  1.0 3.0
   56    55    59    60   0.00000  1.0 1.0
   56    55    59    61   0.00000  1.0 1.0
   57    50    53    54   0.30150 -1.0 2.0
   57    50   -53    52   0.00000  1.0 1.0
   58    57    62    63   0.20000  1.0 3.0
   58    57    62    64   0.20000  1.0 3.0
   58    57    62    65   0.20000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    43   0.44750  1.0 1.0
   40    33    37    43  -0.17800 -1.0 2.0
   40    33    37    43   0.20200  1.0 3.0
   40    33    55    52   0.42250  1.0 1.0
   40    33    55    52  -0.48100 -1.0 2.0
   40    33    55    52   0.35650  1.0 3.0
   40    33    55    56   0.15000  1.0 3.0
   40    33    55    59  -0.84850  1.0 1.0
   40    33    55    59  -0.22800 -1.0 2.0
   40    33    55    59   0.29250  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    47   0.15000  1.0 3.0
   42    40    44    45   0.15000  1.0 3.0
   42    40    44    46   0.15000  1.0 3.0
   42    40    44    47   0.15000  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
   50    52    53    54  10.50000 -1.0 2.0
   55    53    52    48   1.00000 -1.0 2.0
   60    55    59    61  10.50000 -1.0 2.0
END
