* LIGAND DATABASE FILE (OPLS2005)
*
001      65    67    121    194     358
    1     0 S   NP   _N1_     1    28.71843    96.42856   -22.66417
    2     1 S   H    _HN1     2     1.02950    71.85267    13.69743
    3     1 S   H    _H1_     3     1.02828    40.70874   162.42375
    4     1 S   H    _H2_     4     1.02784   100.54066   -92.33806
    5     1 S   CT   _CA1     5     1.50110   143.54567   113.70273
    6     5 S   HC   _HA1     6     1.09572   105.20269    90.85141
    7     5 S   CO3  _C1_     7     1.53790   112.46122   -29.39686
    8     7 S   O2Z  _O11     8     1.26372   115.00684   -42.57858
    9     7 S   O2Z  _O12     9     1.26240   114.94881   136.57918
   10     5 S   CT   _CB1    10     1.53083   107.42520  -151.15693
   11    10 S   HC   HB11    11     1.09831   109.38370   -49.74836
   12    10 S   HC   HB12    12     1.09814   110.44015    66.86155
   13    10 S   CT   _CG1    13     1.52988   112.60129  -170.73070
   14    13 S   HC   HG11    14     1.09582   110.61888   -65.33432
   15    13 S   HC   HG12    15     1.09670   109.79794    53.89347
   16    13 S   C    _CD1    16     1.51800   112.25102   174.35153
   17    16 S   O    _OE1    17     1.22729   123.29584     6.25771
   18    16 S   N    _N2_    18     1.38654   111.65403  -173.84381
   19    18 S   H    _HN2    19     1.01581   118.94020     1.75847
   20    18 S   CT1  _CA2    20     1.46197   123.40227   177.58305
   21    20 S   HC   _HA2    21     1.09735   109.35770     2.27967
   22    20 S   C    _C2_    22     1.53558   108.67379  -113.21034
   23    22 S   O    _O2_    23     1.23059   122.27594  -148.58157
   24    20 S   CT   _CB2    32     1.53321   111.56288   124.29230
   25    24 S   HC   HB21    33     1.09590   110.07205    56.01638
   26    24 S   HC   HB22    34     1.09455   110.01351   175.12219
   27    22 S   N    _N3_    24     1.38323   113.72638    38.89856
   28    27 S   H    _HN3    25     1.01585   119.59185    -3.34369
   29    24 S   S    _SG2    35     1.82841   111.54985   -64.97860
   30    27 S   CT   _CA3    26     1.45284   123.19987   177.11439
   31    30 S   HC   HA31    27     1.09550   107.51431   -64.50993
   32    30 S   HC   HA32    28     1.09557   107.97983    51.92646
   33    29 S   CT   _C16    36     1.83363    99.57745   171.24391
   34    33 S   HC   _H3_    37     1.09723   106.71160   -54.75946
   35    30 S   CO3  _C3_    29     1.52955   114.08588   173.92581
   36    35 S   O2Z  _O31    30     1.26376   116.07212    -0.51091
   37    35 S   O2Z  _O32    31     1.26429   114.41056   179.54716
   38    33 S   CT   _C11    38     1.52542   108.87287  -171.77634
   39    38 S   HC   _H24    39     1.09684   110.34606    59.45057
   40    38 S   HC   _H25    40     1.09611   113.09590   -61.81372
   41    38 S   CO4  _C10    41     1.50807   108.67159   177.35906
   42    41 S   O    _O14    42     1.22582   122.84883  -135.44919
   43    41 S   OS   _O15    43     1.35984   114.86122    44.94588
   44    43 S   CT   _C13    44     1.43946   118.30573    11.95131
   45    44 S   HC   _H27    45     1.09631   108.27825    70.34433
   46    33 S   CT   _C14    46     1.53055   112.05685    66.05439
   47    46 S   HC   _H28    47     1.09725   112.81531    17.16248
   48    46 S   OS   _O16    48     1.43970   108.96242  -101.10789
   49    48 S   CT   _C12    49     1.44009   109.27686  -142.84282
   50    49 S   HC   _H26    50     1.09718   105.79276  -117.35630
   51    49 S   CA   _C9_    51     1.51398   111.33143   125.38792
   52    44 S   CT   _C15    62     1.51430   109.26176  -166.75185
   53    52 S   HC   _H29    63     1.09506   113.15139   -35.14097
   54    51 S   CA   _C7_    52     1.40439   119.02487   156.64867
   55    54 S   HA   _H22    53     1.08761   120.25998    -0.76821
   56    52 S   OH   _O17    64     1.42787   108.54318  -154.87046
   57    56 S   HO   _H31    65     0.97282   107.45721  -179.60042
   58    54 S   CA   _C5_    54     1.39604   120.78795   179.19619
   59    58 S   HA   _H20    55     1.08626   119.96556   179.91153
   60    58 S   CA   _C4_    56     1.39250   120.02943    -0.17246
   61    60 S   HA   _H19    57     1.08608   120.07894  -179.94405
   62    60 S   CA   _C6_    58     1.39287   119.85876    -0.04846
   63    62 S   HA   _H21    59     1.08638   119.96027  -179.82754
   64    51 S   CA   _C8_    60     1.40213   122.47392   -24.55757
   65    64 S   HA   _H23    61     1.08634   120.83591     0.71382
  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
  14   8   2   1   1   9   5   4   6   2   9  11   7   8   3   8
  12   6  12   5   2   8   4   1   1   6   3   5   3   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44    46    47    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48    49    52  
   38    39    40    41    44    46    47    48  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46    47    48  
   40    41    42    43    46  
   41    42    43    46  
   42    43    44    45    46    52  
   43    44  
   44    45    46    47    48    49    52    53    56  
   45    46    47    48    49    50    51    52    53    56    57  
   46    47    48    49    52    53    56  
   47    48    49    50    51    52    53    56  
   48    49    52  
   49    50    51    54    64    52    53    56  
   50    51    54    55    58    62    64    65    52    53    56    57  
   51    54    64    52    53    56  
   54    55    58    59    60    62    63    64    65    52    53    56  
   53    56    57    54    64  
   56    57  
   55    58    59    60    61    62    64    65  
   58    59    60    64  
   57  
    0  
   59    60    61    62    63    64  
   60    61    62  
   61    62    63    64    65  
   62    63    64  
   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   0.107500   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5000   0.0660   0.211800   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   52   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    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    46   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    52   268.000  1.529
   46    47   340.000  1.090
   46    48   320.000  1.410
   48    49   320.000  1.410
   49    50   340.000  1.090
   49    51   317.000  1.510
   49    52   268.000  1.529
   51    54   469.000  1.400
   51    64   469.000  1.400
   54    55   367.000  1.080
   54    58   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   367.000  1.080
   52    53   340.000  1.090
   52    56   320.000  1.410
   56    57   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    46    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    46    44    58.35000  112.70000
   33    46    47    37.50000  110.70000
   33    46    48    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    81.00000  111.40000
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    52    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    50.00000  109.50000
   44    52    49    58.35000  112.70000
   44    52    53    37.50000  110.70000
   44    52    56    50.00000  109.50000
   46    33    34    37.50000  110.70000
   46    33    38    58.35000  112.70000
   46    44    45    37.50000  110.70000
   46    48    49    60.00000  109.50000
   48    46    47    35.00000  109.50000
   48    49    50    35.00000  109.50000
   48    49    51    85.00000  111.85700
   48    49    52    50.00000  109.50000
   49    51    54    70.00000  120.00000
   49    51    64    70.00000  120.00000
   49    52    53    37.50000  110.70000
   49    52    56    50.00000  109.50000
   51    49    50    35.00000  109.50000
   51    54    55    35.00000  120.00000
   51    54    58    63.00000  120.00000
   51    64    62    63.00000  120.00000
   51    64    65    35.00000  120.00000
   54    58    59    35.00000  120.00000
   54    58    60    63.00000  120.00000
   58    54    55    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    62    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    62    63    35.00000  120.00000
   60    62    64    63.00000  120.00000
   62    60    61    35.00000  120.00000
   62    64    65    35.00000  120.00000
   64    51    54    63.00000  120.00000
   64    62    63    35.00000  120.00000
   52    44    45    37.50000  110.70000
   52    44    46    58.35000  112.70000
   52    49    50    37.50000  110.70000
   52    49    51    70.00000  112.17500
   52    56    57    55.00000  108.50000
   56    52    53    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    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   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   0.15000  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    46    44   0.44750  1.0 1.0
   29    33    46    44  -0.17800 -1.0 2.0
   29    33    46    44   0.20200  1.0 3.0
   29    33    46    47   0.15000  1.0 3.0
   29    33    46    48   0.56750  1.0 1.0
   29    33    46    48  -0.07550 -1.0 2.0
   29    33    46    48   0.20000  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   0.36750  1.0 3.0
   33    46    48    49   0.06250  1.0 1.0
   33    46    48    49  -0.01100 -1.0 2.0
   33    46    48    49   0.28050  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    41  -0.11250  1.0 3.0
   34    33    46    44   0.15000  1.0 3.0
   34    33    46    47   0.15000  1.0 3.0
   34    33    46    48   0.23400  1.0 3.0
   38    33    46    44   0.56750  1.0 1.0
   38    33    46    44  -0.07550 -1.0 2.0
   38    33    46    44   0.20000  1.0 3.0
   38    33    46    47   0.15000  1.0 3.0
   38    33    46    48   0.62750  1.0 1.0
   38    33    46    48  -0.30950 -1.0 2.0
   38    33    46    48   0.27300  1.0 3.0
   38    41   -43    44   1.63150  1.0 1.0
   38    41   -43    44   2.92000 -1.0 2.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.25900  1.0 1.0
   41    43    44    46  -0.47000 -1.0 2.0
   41    43    44    46   0.11750  1.0 3.0
   41    43    44    52  -0.25900  1.0 1.0
   41    43    44    52  -0.47000 -1.0 2.0
   41    43    44    52   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44   -46    33   0.62750  1.0 1.0
   43    44   -46    33  -0.30950 -1.0 2.0
   43    44   -46    33   0.27300  1.0 3.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    48   1.11900  1.0 1.0
   43    44    46    48  -1.16350 -1.0 2.0
   43    44    46    48  -0.34150  1.0 3.0
   43    44    52    49   0.62750  1.0 1.0
   43    44    52    49  -0.30950 -1.0 2.0
   43    44    52    49   0.27300  1.0 3.0
   43    44    52    53   0.23400  1.0 3.0
   43    44    52    56   3.69350  1.0 1.0
   43    44    52    56  -1.82950 -1.0 2.0
   44    46   -48    49   0.06250  1.0 1.0
   44    46   -48    49  -0.01100 -1.0 2.0
   44    46   -48    49   0.28050  1.0 3.0
   44    52    56    57  -0.11600  1.0 1.0
   44    52    56    57  -0.09450 -1.0 2.0
   44    52    56    57   0.21250  1.0 3.0
   45    44    46    33   0.15000  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.23400  1.0 3.0
   45    44    52    49   0.15000  1.0 3.0
   45    44    52    53   0.15000  1.0 3.0
   45    44    52    56   0.23400  1.0 3.0
   46    33    38    39   0.15000  1.0 3.0
   46    33    38    40   0.15000  1.0 3.0
   46    33   -38    41  -0.95700  1.0 1.0
   46    33   -38    41  -0.18200 -1.0 2.0
   46    33   -38    41   0.29450  1.0 3.0
   46    44   -52    49   0.56750  1.0 1.0
   46    44   -52    49  -0.07550 -1.0 2.0
   46    44   -52    49   0.20000  1.0 3.0
   46    44    52    53   0.15000  1.0 3.0
   46    44    52    56   0.86500  1.0 1.0
   46    44    52    56  -0.17500 -1.0 2.0
   46    44    52    56   0.20800  1.0 3.0
   46    48    49    50   0.37050  1.0 3.0
   46    48    49    51   0.37500  1.0 3.0
   46    48   -49    52   0.06250  1.0 1.0
   46    48   -49    52  -0.01100 -1.0 2.0
   46    48   -49    52   0.28050  1.0 3.0
   47    46    48    49   0.37050  1.0 3.0
   48    49    51    54   0.64500  1.0 1.0
   48    49    51    54   0.14800 -1.0 2.0
   48    49    51    54   0.20650  1.0 3.0
   48    49    51    64   0.64500  1.0 1.0
   48    49    51    64   0.14800 -1.0 2.0
   48    49    51    64   0.20650  1.0 3.0
   48    49   -52    44   0.62750  1.0 1.0
   48    49   -52    44  -0.30950 -1.0 2.0
   48    49   -52    44   0.27300  1.0 3.0
   48    49    52    53   0.23400  1.0 3.0
   48    49    52    56   3.69350  1.0 1.0
   48    49    52    56  -1.82950 -1.0 2.0
   49    51    54    55   3.62500 -1.0 2.0
   49    51    54    58   3.62500 -1.0 2.0
   49    51    64    62   3.62500 -1.0 2.0
   49    51    64    65   3.62500 -1.0 2.0
   49    52    56    57  -0.11600  1.0 1.0
   49    52    56    57  -0.09450 -1.0 2.0
   49    52    56    57   0.21250  1.0 3.0
   50    49    51    54   0.00000  1.0 1.0
   50    49    51    64   0.00000  1.0 1.0
   50    49    52    44   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    56   0.23400  1.0 3.0
   51    49    52    44  -0.03700  1.0 1.0
   51    49    52    44   0.37200 -1.0 2.0
   51    49    52    44  -0.47300  1.0 3.0
   51    49    52    53   0.43200  1.0 3.0
   51    49    52    56   1.13150  1.0 1.0
   51    49    52    56  -1.01400 -1.0 2.0
   51    54    58    59   3.62500 -1.0 2.0
   51    54    58    60   3.62500 -1.0 2.0
   54    51    64    62   3.62500 -1.0 2.0
   54    51    64    65   3.62500 -1.0 2.0
   54    58    60    61   3.62500 -1.0 2.0
   54    58   -60    62   3.62500 -1.0 2.0
   55    54    58    59   3.62500 -1.0 2.0
   55    54    58    60   3.62500 -1.0 2.0
   58    60    62    63   3.62500 -1.0 2.0
   58    60    62    64   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   60    62   -64    51   3.62500 -1.0 2.0
   60    62    64    65   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    64   3.62500 -1.0 2.0
   63    62    64    51   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    51    54    55   3.62500 -1.0 2.0
   64    51   -54    58   3.62500 -1.0 2.0
   52    44    46    33   0.56750  1.0 1.0
   52    44    46    33  -0.07550 -1.0 2.0
   52    44    46    33   0.20000  1.0 3.0
   52    44    46    47   0.15000  1.0 3.0
   52    44   -46    48   0.62750  1.0 1.0
   52    44   -46    48  -0.30950 -1.0 2.0
   52    44   -46    48   0.27300  1.0 3.0
   52    49    51    54   0.04150 -1.0 2.0
   52    49    51    64   0.04150 -1.0 2.0
   53    52    56    57   0.19450  1.0 3.0
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
   38    43    41    42  10.50000 -1.0 2.0
   54    64    51    49   4.00000 -1.0 2.0
   58    55    54    51   1.10000 -1.0 2.0
   60    59    58    54   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   64    63    62    60   1.10000 -1.0 2.0
   62    65    64    51   1.10000 -1.0 2.0
END
