* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    114    172     334
    1     0 S   NP   _N1_     1    28.71827    95.56871   -24.27665
    2     1 S   H    _HN1     2     1.02783   109.02673   -84.54282
    3     1 S   H    _H1_     3     1.02950    75.40044    20.18536
    4     1 S   H    _H2_     4     1.02830    33.35763  -178.37442
    5     1 S   CT   _CA1     5     1.50109   133.25463   124.64971
    6     5 S   HC   _HA1     6     1.09572   105.22145    88.78791
    7     5 S   CO3  _C1_     7     1.53796   112.38386   -31.48232
    8     7 S   O2Z  _O11     8     1.26372   115.00863   -44.23577
    9     7 S   O2Z  _O12     9     1.26235   114.93812   134.89643
   10     5 S   CT   _CB1    10     1.53082   107.42590  -153.23727
   11    10 S   HC   HB11    11     1.09830   109.41502   -49.88642
   12    10 S   HC   HB12    12     1.09815   110.43030    66.71965
   13    10 S   CT   _CG1    13     1.52990   112.59234  -170.87708
   14    13 S   HC   HG11    14     1.09589   110.58580   -64.26689
   15    13 S   HC   HG12    15     1.09665   109.84864    54.96749
   16    13 S   C    _CD1    16     1.51798   112.24855   175.43014
   17    16 S   O    _OE1    17     1.22732   123.29588     4.34956
   18    16 S   N    _N2_    18     1.38645   111.65666  -175.82909
   19    18 S   H    _HN2    19     1.01591   118.96611     1.81013
   20    18 S   CT1  _CA2    20     1.46184   123.36387   178.52740
   21    20 S   HC   _HA2    21     1.09736   109.35660    -0.63735
   22    20 S   C    _C2_    22     1.53480   108.67957  -116.16303
   23    22 S   O    _O2_    23     1.23051   122.27646  -148.49280
   24    20 S   CT   _CB2    32     1.53324   111.55758   121.30531
   25    24 S   HC   HB21    33     1.09586   110.03416    56.56126
   26    24 S   HC   HB22    34     1.09461   110.03833   175.66072
   27    22 S   N    _N3_    24     1.38328   113.66247    39.00374
   28    27 S   H    _HN3    25     1.01605   119.56002    -3.55661
   29    24 S   S    _SG2    35     1.82823   111.47238   -64.31764
   30    27 S   CT   _CA3    26     1.45287   123.16152   177.01187
   31    30 S   HC   HA31    27     1.09551   107.52550   -63.98336
   32    30 S   HC   HA32    28     1.09558   107.95619    52.43671
   33    29 S   CT   _C14    36     1.85181    99.63335   173.03748
   34    33 S   HC   _H3_    37     1.09750   106.08444   -45.72438
   35    30 S   CO3  _C3_    29     1.52946   114.11353   174.41777
   36    35 S   O2Z  _O31    30     1.26372   116.06367    -0.78833
   37    35 S   O2Z  _O32    31     1.26430   114.41201   179.27449
   38    33 S   CA   _C6_    38     1.52283   110.10689    72.44812
   39    33 S   CT   _C15    53     1.55134   110.14708  -162.35203
   40    39 S   HC   _H30    54     1.09764   109.44139   -59.62267
   41    38 S   CA   _C4_    39     1.40490   119.41659  -114.03158
   42    41 S   HA   _H21    40     1.08806   119.88665    -0.21489
   43    39 S   CO4  _C10    55     1.52923   111.01738  -178.06741
   44    43 S   O    _O15    56     1.23089   122.21339   -42.69902
   45    39 S   CO4  _C11    61     1.52814   111.40059    60.06905
   46    45 S   O    _O16    62     1.23097   121.98027    53.06289
   47    41 S   CA   _C7_    41     1.39853   119.71411  -179.70392
   48    43 S   CT   _C12    57     1.50658   116.72850   139.58162
   49    48 S   HC   _H23    58     1.09238   109.67557    61.91841
   50    48 S   HC   _H24    59     1.09353   109.66031  -178.47376
   51    48 S   HC   _H25    60     1.09281   109.60807   -59.28891
   52    45 S   CT   _C13    63     1.50659   116.86995  -128.85292
   53    52 S   HC   _H26    64     1.09268   109.71509    58.73811
   54    52 S   HC   _H27    65     1.09353   109.65655   178.00482
   55    52 S   HC   _H28    66     1.09247   109.61132   -62.42105
   56    47 S   CA   _C9_    42     1.39176   121.54959    -0.36691
   57    47 S   NO2  _N13    50     1.44645   118.07310   179.70459
   58    57 S   ON   _O14    51     1.23790   117.38148  -123.70673
   59    57 S   ON   _O17    52     1.23818   116.99246    55.31596
   60    56 S   CA   _C8_    43     1.39191   118.70960     0.35882
   61    56 S   OH   _O19    48     1.36542   121.07084  -178.67219
   62    61 S   HO   _H32    49     0.97436   107.47707   179.94766
   63    38 S   CA   _C5_    44     1.40745   121.79604    66.17179
   64    63 S   HA   _H22    45     1.08725   119.99290    -0.48979
   65    60 S   OH   _O18    46     1.36822   118.51961  -179.84423
   66    65 S   HO   _H31    47     0.97273   108.71701   179.17433
  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   9   5   4   3
  16   7   2   1   1  13  15   6  10   4   8   5   6   4   9   3
   2   1   1   3   2   1   1  10   4   1   1   6   3   1   3   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    63    39    40    43    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    60    63    64    39    40    43    44    48    45    46    52  
   38    41    63    39    40    43    45  
   36    37  
   37  
    0  
   41    42    47    56    60    63    64    65    57    39    40    43    45  
   40    43    44    48    49    50    51    45    46    52    53    54    55    41    63  
   43    44    48    45    46    52  
   42    47    56    60    63    64    61    57    58    59  
   47    56    63    57  
   44    48    49    50    51    45    46    52  
   48    49    50    51    45  
   46    52    53    54    55    48  
   52    53    54    55  
   56    60    63    65    61    62    57    58    59  
   49    50    51  
   50    51  
   51  
    0  
   53    54    55  
   54    55  
   55  
    0  
   60    63    64    65    66    61    62    57    58    59  
   58    59    60    61  
   59  
    0  
   63    64    65    66    61    62  
   62    63    65  
    0  
   64    65    66  
   65  
   66  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   58   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   59   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   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   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    63   469.000  1.400
   41    42   367.000  1.080
   41    47   469.000  1.400
   47    56   469.000  1.400
   47    57   400.000  1.460
   56    60   469.000  1.400
   56    61   450.000  1.364
   60    63   469.000  1.400
   60    65   450.000  1.364
   63    64   367.000  1.080
   65    66   553.000  0.945
   61    62   553.000  0.945
   57    58   550.000  1.225
   57    59   550.000  1.225
   39    40   340.000  1.090
   39    43   317.000  1.522
   39    45   317.000  1.522
   43    44   570.000  1.229
   43    48   317.000  1.522
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   45    46   570.000  1.229
   45    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    63    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   33    39    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    63    60    63.00000  120.00000
   38    63    64    35.00000  120.00000
   41    47    56    63.00000  120.00000
   41    47    57    85.00000  120.00000
   47    41    42    35.00000  120.00000
   47    56    60    63.00000  120.00000
   47    56    61    70.00000  120.00000
   47    57    58    80.00000  117.50000
   47    57    59    80.00000  117.50000
   56    60    63    63.00000  120.00000
   56    60    65    70.00000  120.00000
   56    61    62    35.00000  113.00000
   60    63    64    35.00000  120.00000
   60    65    66    35.00000  113.00000
   63    38    41    63.00000  120.00000
   65    60    63    70.00000  120.00000
   61    56    60    70.00000  120.00000
   57    47    56    85.00000  120.00000
   59    57    58    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    48    70.00000  116.00000
   39    45    46    80.00000  120.40000
   39    45    52    70.00000  116.00000
   43    39    40    35.00000  109.50000
   43    48    49    35.00000  109.50000
   43    48    50    35.00000  109.50000
   43    48    51    35.00000  109.50000
   48    43    44    80.00000  120.40000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   45    39    40    35.00000  109.50000
   45    39    43    75.00000  107.99600
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    55    35.00000  109.50000
   52    45    46    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    63  -0.16000  1.0 1.0
   29    33    38    63  -0.03200 -1.0 2.0
   29    33    38    63   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    63    60   3.62500 -1.0 2.0
   33    38    63    64   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    48   0.60050  1.0 1.0
   33    39    43    48   0.05600 -1.0 2.0
   33    39    43    48   0.26150  1.0 3.0
   33    39    45    46   0.30150 -1.0 2.0
   33    39    45    52   0.60050  1.0 1.0
   33    39    45    52   0.05600 -1.0 2.0
   33    39    45    52   0.26150  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    63   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43  -0.11250  1.0 3.0
   34    33    39    45  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    45   0.56750  1.0 1.0
   38    33    39    45  -0.07550 -1.0 2.0
   38    33    39    45   0.20000  1.0 3.0
   38    41    47    56   3.62500 -1.0 2.0
   38    41    47    57   3.62500 -1.0 2.0
   41    38    63    60   3.62500 -1.0 2.0
   41    38    63    64   3.62500 -1.0 2.0
   41    47   -56    60   3.62500 -1.0 2.0
   41    47    56    61   3.62500 -1.0 2.0
   41    47    57    58   0.69950 -1.0 2.0
   41    47    57    59   0.69950 -1.0 2.0
   42    41    47    56   3.62500 -1.0 2.0
   42    41    47    57   3.62500 -1.0 2.0
   47    56    60    63   3.62500 -1.0 2.0
   47    56    60    65   3.62500 -1.0 2.0
   47    56    61    62   0.84100 -1.0 2.0
   56    47    57    58   0.69950 -1.0 2.0
   56    47    57    59   0.69950 -1.0 2.0
   56    60   -63    38   3.62500 -1.0 2.0
   56    60    63    64   3.62500 -1.0 2.0
   56    60    65    66   0.84100 -1.0 2.0
   60    56    61    62   0.84100 -1.0 2.0
   63    38    41    42   3.62500 -1.0 2.0
   63    38   -41    47   3.62500 -1.0 2.0
   63    60    65    66   0.84100 -1.0 2.0
   65    60    63    38   3.62500 -1.0 2.0
   65    60    63    64   3.62500 -1.0 2.0
   61    56    60    63   3.62500 -1.0 2.0
   61    56    60    65   3.62500 -1.0 2.0
   57    47    56    60   3.62500 -1.0 2.0
   57    47    56    61   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    63   0.04150 -1.0 2.0
   39    43    48    49   0.00000  1.0 1.0
   39    43    48    50   0.00000  1.0 1.0
   39    43    48    51   0.00000  1.0 1.0
   39    45    52    53   0.00000  1.0 1.0
   39    45    52    54   0.00000  1.0 1.0
   39    45    52    55   0.00000  1.0 1.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    48   0.00000  1.0 1.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    52   0.00000  1.0 1.0
   43    39    45    46   0.30150 -1.0 2.0
   43    39    45    52   0.65300  1.0 1.0
   43    39    45    52  -0.03850 -1.0 2.0
   43    39    45    52   0.33900  1.0 3.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.00000  1.0 1.0
   44    43    48    51   0.00000  1.0 1.0
   45    39    43    44   0.30150 -1.0 2.0
   45    39    43    48   0.65300  1.0 1.0
   45    39    43    48  -0.03850 -1.0 2.0
   45    39    43    48   0.33900  1.0 3.0
   46    45    52    53   0.00000  1.0 1.0
   46    45    52    54   0.00000  1.0 1.0
   46    45    52    55   0.00000  1.0 1.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   41    63    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   56    57    47    41   4.00000 -1.0 2.0
   60    61    56    47   4.00000 -1.0 2.0
   63    65    60    56   4.00000 -1.0 2.0
   60    64    63    38   1.10000 -1.0 2.0
   59    47    57    58  10.50000 -1.0 2.0
   39    48    43    44  10.50000 -1.0 2.0
   39    52    45    46  10.50000 -1.0 2.0
END
