* LIGAND DATABASE FILE (OPLS2005)
*
001      65    67    120    192     353
    1     0 S   NP   _N1_     1    28.89910    94.73223   -20.00659
    2     1 S   H    _HN1     2     1.02764    85.43162   -69.82514
    3     1 S   H    _H1_     3     1.02961    93.20529    38.43953
    4     1 S   H    _H2_     4     1.02831    32.44084   155.48108
    5     1 S   CT   _CA1     5     1.50237   142.58815   168.55110
    6     5 S   HC   _HA1     6     1.09582   105.06900    51.62158
    7     5 S   CO3  _C1_     7     1.53840   112.53751   -68.07633
    8     7 S   O2Z  _O11     8     1.26367   114.97531   -34.24841
    9     7 S   O2Z  _O12     9     1.26265   114.94210   144.46885
   10     5 S   CT   _CB1    10     1.53094   107.32256   169.38683
   11    10 S   HC   HB11    11     1.09816   109.10919   -49.42708
   12    10 S   HC   HB12    12     1.09810   110.39352    66.99051
   13    10 S   CT   _CG1    13     1.53028   112.92495  -170.60644
   14    13 S   HC   HG11    14     1.09541   110.38302   -66.10768
   15    13 S   HC   HG12    15     1.09651   110.08305    53.01367
   16    13 S   C    _CD1    16     1.51874   112.34919   172.87734
   17    16 S   O    _OE1    17     1.22727   123.20092    -9.80079
   18    16 S   N    _N2_    18     1.38629   111.73936   171.23095
   19    18 S   H    _HN2    19     1.01612   118.87304    -0.64619
   20    18 S   CT1  _CA2    20     1.46291   123.54269   178.95582
   21    20 S   HC   _HA2    21     1.09749   109.13221   -19.70518
   22    20 S   C    _C2_    22     1.53463   107.97424  -135.09007
   23    22 S   O    _O2_    23     1.22994   122.35516  -145.17021
   24    20 S   CT   _CB2    32     1.53489   111.81868   102.67494
   25    24 S   HC   HB21    33     1.09517   110.18931    54.03181
   26    24 S   HC   HB22    34     1.09525   110.48716   172.06447
   27    22 S   N    _N3_    24     1.38545   113.24552    42.13576
   28    27 S   H    _HN3    25     1.01537   118.91605    -0.47147
   29    24 S   S    _SG2    35     1.82896   111.83549   -69.60592
   30    27 S   CT   _CA3    26     1.45455   123.46182   175.07161
   31    30 S   HC   HA31    27     1.09522   109.24212    24.02817
   32    30 S   HC   HA32    28     1.09494   107.11100   141.05472
   33    29 S   CT   _C16    36     1.86650   100.45209   135.07847
   34    33 S   HC   _H4_    37     1.09647   105.15922    42.91078
   35    30 S   CO3  _C3_    29     1.52937   113.15423   -99.44116
   36    35 S   O2Z  _O31    30     1.26400   115.44079   -42.90089
   37    35 S   O2Z  _O32    31     1.26359   114.95289   138.03076
   38    33 S   CT   _C15    38     1.53005   107.38212   -76.22364
   39    38 S   Br   Br1_    39     1.95036   112.65761   160.00627
   40    38 S   HC   _H3_    40     1.09449   111.52160    44.61721
   41    38 S   CO4  _C14    41     1.51484   114.77849   -78.39730
   42    41 S   O    _O34    42     1.23169   120.41197   161.67704
   43    41 S   CM   _C13    43     1.49284   119.02041   -19.45908
   44    43 S   Br   Br2_    44     1.86751   118.03328   177.39413
   45    43 S   CM   _C12    45     1.34053   120.20355    -3.88030
   46    45 S   HC   _H9_    46     1.08915   118.72076  -177.91325
   47    33 S   CT   _C11    47     1.56000   110.25982   160.04038
   48    47 S   CT   _C10    48     1.55566   112.31048  -160.00525
   49    48 S   HC   _H7_    49     1.09511   112.17416    22.71607
   50    48 S   HC   _H8_    50     1.09457   113.40437  -102.28451
   51    47 S   OS   _O33    60     1.46560   108.75808   -42.57927
   52    48 S   CA   _C9_    51     1.48157   100.85771   137.48230
   53    52 S   CA   _C4_    52     1.38462   129.17477   170.22835
   54    53 S   HA   _H5_    53     1.08585   120.42352    -2.28113
   55    53 S   CA   _C5_    54     1.40346   118.70985   177.21512
   56    55 S   CA   _C6_    55     1.41117   119.66945    -1.36013
   57    56 S   HA   _H6_    56     1.08812   119.30804  -178.80074
   58    55 S   CT   _C17    61     1.50205   120.21020  -179.15721
   59    58 S   HC   _H10    62     1.09538   110.78251  -149.34616
   60    58 S   HC   _H11    63     1.09538   110.87741   -29.56959
   61    56 S   CA   _C7_    57     1.39742   120.58216     0.93230
   62    61 S   Br   Br3_    58     1.88753   120.07822   179.91607
   63    58 S   OH   _O35    64     1.41905   108.97133    90.53638
   64    63 S   HO   _H12    65     0.97223   107.04149   179.90309
   65    52 S   CA   _C8_    59     1.38164   109.55780   -13.07245
  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
  16   8   2   1   1  10   5   4   6   3   6   3   8   3   8   9
   5   4   6   8  10   4  10   8   4   5   3   2   2   1   1   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    45    47    48    51  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    45    46    47    48    49    50    52    65    51  
   38    39    40    41    45    47    48    51  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    47    48    51  
   40    41    42    43    47  
   41    42    43    47  
   42    43    44    45    46    47  
   43    44    45  
   44    45    46    47    48    51  
   45    46    47  
   46    47    48    49    50    52    65    51  
   47    48    51  
   48    49    50    52    53    61    65    51  
   49    50    52    53    54    55    61    65    51  
   50    52    53    65    51  
   52    53    65    51  
   52    53    56    61    62    65  
   53    54    55    56    61    62    65    58  
   54    55    56    57    61    65    58    59    60    63  
   55    56    65    58  
   56    57    61    62    65    58    59    60    63    64  
   57    61    62    65    58    59    60    63  
   61    62    65    58  
   59    60    63    64    61  
   60    63    64  
   63    64  
   62    65  
   65  
   64  
    0  
    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   0.218000   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  -0.053000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.4700   0.4700  -0.203900   2.8000   2.5000   0.001000000  -0.686339560
   40   2.4200   0.0150   0.146400   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0760   0.179500   2.0020   1.7750   0.023028004  -0.852763146
   44   3.4700   0.4700  -0.179500   2.8000   2.5000   0.001000000  -0.686339560
   45   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.269000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.077900   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660   0.197200   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.048000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.048000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.4700   0.4700  -0.200000   2.8000   2.5000   0.001000000  -0.686339560
   63   3.1200   0.1700  -0.633300   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
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    47   268.000  1.529
   38    39   245.000  1.990
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   320.000  1.462
   43    44   165.000  1.979
   43    45   549.000  1.340
   45    46   340.000  1.080
   45    47   317.000  1.510
   47    48   268.000  1.529
   47    51   320.000  1.410
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    52   317.000  1.510
   52    53   469.000  1.400
   52    65   469.000  1.400
   53    54   367.000  1.080
   53    55   469.000  1.400
   55    56   469.000  1.400
   55    58   317.000  1.510
   56    57   367.000  1.080
   56    61   469.000  1.400
   61    62   300.000  1.903
   61    65   469.000  1.400
   65    51   450.000  1.364
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   320.000  1.410
   63    64   553.000  0.945
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    47    75.00000  111.63000
   33    38    39    70.00000  109.17700
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    47    45    70.00000  112.02700
   33    47    48    58.35000  112.70000
   33    47    51    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    65.00000  118.62400
   40    38    39    51.00000  107.60000
   41    38    39    70.00000  108.30000
   41    38    40    35.00000  109.50000
   41    43    44    65.00000  121.00000
   41    43    45    65.00000  118.96000
   43    41    42    80.00000  123.72100
   43    45    46    35.00000  120.00000
   43    45    47    70.00000  124.00000
   45    43    44    65.00000  115.01300
   45    47    48    70.00000  112.02700
   45    47    51    85.00000  110.90400
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    45    46    35.00000  117.00000
   47    48    49    37.50000  110.70000
   47    48    50    37.50000  110.70000
   47    48    52    70.00000  112.17500
   47    51    65    75.00000  111.00000
   48    52    53    70.00000  120.00000
   48    52    65    70.00000  120.00000
   50    48    49    33.00000  107.80000
   52    48    49    35.00000  109.50000
   52    48    50    35.00000  109.50000
   52    53    54    35.00000  120.00000
   52    53    55    63.00000  120.00000
   52    65    61    63.00000  120.00000
   52    65    51    70.00000  120.00000
   53    55    56    63.00000  120.00000
   53    55    58    70.00000  120.00000
   55    53    54    35.00000  120.00000
   55    56    57    35.00000  120.00000
   55    56    61    63.00000  120.00000
   55    58    59    35.00000  109.50000
   55    58    60    35.00000  109.50000
   55    58    63    90.00000  112.51600
   56    61    62    75.00000  120.00000
   56    61    65    63.00000  120.00000
   61    56    57    35.00000  120.00000
   61    65    51    70.00000  120.00000
   65    52    53    63.00000  120.00000
   65    61    62    75.00000  120.00000
   51    47    48    50.00000  109.50000
   58    55    56    70.00000  120.00000
   58    63    64    55.00000  108.50000
   60    58    59    33.00000  107.80000
   63    58    59    35.00000  109.50000
   63    58    60    35.00000  109.50000
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    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    47    45   0.56750  1.0 1.0
   29    33    47    45  -0.07550 -1.0 2.0
   29    33    47    45   0.20000  1.0 3.0
   29    33    47    48   0.44750  1.0 1.0
   29    33    47    48  -0.17800 -1.0 2.0
   29    33    47    48   0.20200  1.0 3.0
   29    33    47    51   0.56750  1.0 1.0
   29    33    47    51  -0.07550 -1.0 2.0
   29    33    47    51   0.20000  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   0.65300  1.0 1.0
   33    38    41    43  -0.03850 -1.0 2.0
   33    38    41    43   0.33900  1.0 3.0
   33    47    48    49   0.15000  1.0 3.0
   33    47    48    50   0.15000  1.0 3.0
   33    47    48    52  -0.03700  1.0 1.0
   33    47    48    52   0.37200 -1.0 2.0
   33    47    48    52  -0.47300  1.0 3.0
   33    47    51    65  -0.32850  1.0 1.0
   33    47    51    65  -0.35800 -1.0 2.0
   33    47    51    65   0.33950  1.0 3.0
   34    33    38    39   0.39750  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    47    45   0.15000  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   34    33    47    51   0.23400  1.0 3.0
   38    33    47    45   0.34400  1.0 1.0
   38    33    47    45   0.09450 -1.0 2.0
   38    33    47    45   0.11100  1.0 3.0
   38    33    47    48   0.56750  1.0 1.0
   38    33    47    48  -0.07550 -1.0 2.0
   38    33    47    48   0.20000  1.0 3.0
   38    33    47    51   0.62750  1.0 1.0
   38    33    47    51  -0.30950 -1.0 2.0
   38    33    47    51   0.27300  1.0 3.0
   38    41    43    44   1.50000 -1.0 2.0
   38    41   -43    45  -0.33500  1.0 1.0
   38    41   -43    45   1.06600 -1.0 2.0
   38    41   -43    45  -0.14000  1.0 3.0
   39    38    41    42   0.30150 -1.0 2.0
   39    38    41    43   0.65300  1.0 1.0
   39    38    41    43  -0.03850 -1.0 2.0
   39    38    41    43   0.33900  1.0 3.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    45    46   7.00000 -1.0 2.0
   41    43    45    47   7.00000 -1.0 2.0
   42    41    43    44  -0.52200  1.0 1.0
   42    41    43    44   0.82950 -1.0 2.0
   42    41    43    45   1.00000 -1.0 2.0
   43    45   -47    33   0.09850  1.0 1.0
   43    45   -47    33   0.15250 -1.0 2.0
   43    45   -47    33  -0.50650  1.0 3.0
   43    45    47    48   0.09850  1.0 1.0
   43    45    47    48   0.15250 -1.0 2.0
   43    45    47    48  -0.50650  1.0 3.0
   43    45    47    51   0.39000  1.0 1.0
   43    45    47    51  -0.05800 -1.0 2.0
   43    45    47    51  -0.55150  1.0 3.0
   44    43    45    46   7.00000 -1.0 2.0
   44    43    45    47   7.00000 -1.0 2.0
   45    47    48    49   0.15000  1.0 3.0
   45    47    48    50   0.15000  1.0 3.0
   45    47    48    52   0.21200  1.0 1.0
   45    47    48    52   0.16900 -1.0 2.0
   45    47    48    52  -1.15100  1.0 3.0
   45    47    51    65  -0.25600  1.0 1.0
   45    47    51    65  -0.40050 -1.0 2.0
   45    47    51    65   0.34700  1.0 3.0
   46    45    47    33   0.00000  1.0 1.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    51   0.00000  1.0 1.0
   47    33    38    39   0.74700  1.0 1.0
   47    33    38    39  -0.19600 -1.0 2.0
   47    33    38    39   0.19200  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41  -0.95700  1.0 1.0
   47    33   -38    41  -0.18200 -1.0 2.0
   47    33   -38    41   0.29450  1.0 3.0
   47    48    52    53   0.04150 -1.0 2.0
   47    48   -52    65   0.04150 -1.0 2.0
   48    47   -51    65  -0.32850  1.0 1.0
   48    47   -51    65  -0.35800 -1.0 2.0
   48    47   -51    65   0.33950  1.0 3.0
   48    52    53    54   3.62500 -1.0 2.0
   48    52    53    55   3.62500 -1.0 2.0
   48    52    65    61   3.62500 -1.0 2.0
   48    52   -65    51   3.62500 -1.0 2.0
   49    48    52    53   0.00000  1.0 1.0
   49    48    52    65   0.00000  1.0 1.0
   50    48    52    53   0.00000  1.0 1.0
   50    48    52    65   0.00000  1.0 1.0
   52    53    55    56   3.62500 -1.0 2.0
   52    53    55    58   3.62500 -1.0 2.0
   52    65   -51    47   1.63200 -1.0 2.0
   53    52    65    61   3.62500 -1.0 2.0
   53    52    65    51   3.62500 -1.0 2.0
   53    55    56    57   3.62500 -1.0 2.0
   53    55   -56    61   3.62500 -1.0 2.0
   53    55    58    59   0.00000  1.0 1.0
   53    55    58    60   0.00000  1.0 1.0
   53    55    58    63   0.14300 -1.0 2.0
   53    55    58    63   0.00300  1.0 3.0
   54    53    55    56   3.62500 -1.0 2.0
   54    53    55    58   3.62500 -1.0 2.0
   55    56    61    62   3.62500 -1.0 2.0
   55    56    61    65   3.62500 -1.0 2.0
   55    58    63    64   0.31900  1.0 1.0
   55    58    63    64  -0.11800 -1.0 2.0
   55    58    63    64   0.38750  1.0 3.0
   56    55    58    59   0.00000  1.0 1.0
   56    55    58    60   0.00000  1.0 1.0
   56    55    58    63   0.14300 -1.0 2.0
   56    55    58    63   0.00300  1.0 3.0
   56    61   -65    52   3.62500 -1.0 2.0
   56    61    65    51   3.62500 -1.0 2.0
   57    56    61    62   3.62500 -1.0 2.0
   57    56    61    65   3.62500 -1.0 2.0
   61    65    51    47   1.63200 -1.0 2.0
   62    61    65    52   3.62500 -1.0 2.0
   62    61    65    51   3.62500 -1.0 2.0
   65    52    53    54   3.62500 -1.0 2.0
   65    52   -53    55   3.62500 -1.0 2.0
   51    47    48    49   0.23400  1.0 3.0
   51    47    48    50   0.23400  1.0 3.0
   51    47   -48    52  -0.64350  1.0 1.0
   51    47   -48    52  -0.04200 -1.0 2.0
   51    47   -48    52   0.19800  1.0 3.0
   58    55    56    57   3.62500 -1.0 2.0
   58    55    56    61   3.62500 -1.0 2.0
   59    58    63    64   0.19450  1.0 3.0
   60    58    63    64   0.19450  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
   38    43    41    42  10.50000 -1.0 2.0
   41    44    43    45   1.10000 -1.0 2.0
   47    46    45    43   1.10000 -1.0 2.0
   53    65    52    48   4.00000 -1.0 2.0
   55    54    53    52   1.10000 -1.0 2.0
   56    58    55    53   4.00000 -1.0 2.0
   61    57    56    55   1.10000 -1.0 2.0
   65    62    61    56   4.00000 -1.0 2.0
   61    51    65    52   4.00000 -1.0 2.0
END
