* LIGAND DATABASE FILE (OPLS2005)
*
001      65    67    121    194     358
    1     0 S   NP   _N1_     1    29.02905    95.58744   -20.62905
    2     1 S   H    _HN1     2     1.02774    89.78985   -85.64483
    3     1 S   H    _H1_     3     1.02953    81.05744    23.02029
    4     1 S   H    _H2_     4     1.02824    38.98761   154.75970
    5     1 S   CT   _CA1     5     1.50143   148.83498   137.84865
    6     5 S   HC   _HA1     6     1.09568   105.18444    70.49122
    7     5 S   CO3  _C1_     7     1.53810   112.42540   -49.68900
    8     7 S   O2Z  _O11     8     1.26363   114.95639   -40.13684
    9     7 S   O2Z  _O12     9     1.26242   115.00373   138.88124
   10     5 S   CT   _CB1    10     1.53089   107.39098  -171.46673
   11    10 S   HC   HB11    11     1.09824   109.42894   -48.60345
   12    10 S   HC   HB12    12     1.09815   110.41537    68.05653
   13    10 S   CT   _CG1    13     1.52939   112.59784  -169.58444
   14    13 S   HC   HG11    14     1.09445   110.49253   -64.41973
   15    13 S   HC   HG12    15     1.09664   109.89850    54.72750
   16    13 S   C    _CD1    16     1.51775   112.40000   175.10911
   17    16 S   O    _OE1    17     1.22722   123.32263     1.11382
   18    16 S   N    _N2_    18     1.38644   111.58760  -178.58252
   19    18 S   H    _HN2    19     1.01587   118.88965     1.00911
   20    18 S   CT1  _CA2    20     1.46157   123.38918   177.77630
   21    20 S   HC   _HA2    21     1.09733   109.38901    -4.18348
   22    20 S   C    _C2_    22     1.53447   108.33834  -119.60096
   23    22 S   O    _O2_    23     1.23036   122.34438  -147.52343
   24    20 S   CT   _CB2    32     1.53261   111.63393   117.96603
   25    24 S   HC   HB21    33     1.09502   110.30511    57.74141
   26    24 S   HC   HB22    34     1.09541   110.34700   175.60707
   27    22 S   N    _N3_    24     1.38352   113.54608    39.88186
   28    27 S   H    _HN3    25     1.01623   119.53084    -3.40398
   29    24 S   S    _SG2    35     1.82868   111.64390   -65.86812
   30    27 S   CT   _CA3    26     1.45282   123.16046   177.08496
   31    30 S   HC   HA31    27     1.09550   107.52851   -64.06956
   32    30 S   HC   HA32    28     1.09558   107.95244    52.34837
   33    29 S   CT   _C16    36     1.83344   100.23396   131.79179
   34    33 S   HC   _H3_    37     1.09711   107.82309    47.40145
   35    30 S   CO3  _C3_    29     1.52942   114.11542   174.35062
   36    35 S   O2Z  _O31    30     1.26368   116.06734    -0.10835
   37    35 S   O2Z  _O32    31     1.26429   114.40994   179.94065
   38    33 S   CT   _C11    38     1.51873   108.63586   164.92353
   39    38 S   HC   _H24    39     1.09615   111.99934    53.91116
   40    38 S   HC   _H25    40     1.09754   109.33111   -65.46089
   41    38 S   CO4  _C10    41     1.50529   113.11922   175.11942
   42    41 S   O    _O14    42     1.22903   121.05915   153.21605
   43    41 S   OS   _O15    43     1.35180   117.68218   -32.14945
   44    43 S   CT   _C13    44     1.44560   124.60050    18.90507
   45    44 S   HC   _H27    45     1.09510   107.36407    99.52098
   46    33 S   CT   _C14    46     1.51930   112.32222   -73.35342
   47    46 S   HC   _H28    47     1.09672   111.70892    58.72881
   48    46 S   OS   _O16    48     1.43623   112.80416   -62.49021
   49    48 S   CT   _C12    49     1.44343   107.57404  -154.70299
   50    49 S   HC   _H26    50     1.09688   105.91364  -101.65687
   51    49 S   CA   _C9_    51     1.51142   111.80011   140.61746
   52    44 S   CT   _C15    62     1.51888   108.19895  -138.29065
   53    52 S   HC   _H29    63     1.09532   113.56429   -30.55988
   54    51 S   CA   _C7_    52     1.40414   118.97822   154.25565
   55    54 S   HA   _H22    53     1.08797   120.20226    -1.22301
   56    52 S   OH   _O17    64     1.42737   109.62651  -151.25894
   57    56 S   HO   _H31    65     0.97272   107.41840    68.67496
   58    54 S   CA   _C5_    54     1.39584   120.82604   179.23613
   59    58 S   HA   _H20    55     1.08612   119.90966   179.53019
   60    58 S   CA   _C4_    56     1.39228   120.00578    -0.32445
   61    60 S   HA   _H19    57     1.08594   120.07704   179.94766
   62    60 S   CA   _C6_    58     1.39286   119.83309    -0.00000
   63    62 S   HA   _H21    59     1.08631   119.96039  -179.94405
   64    51 S   CA   _C8_    60     1.40080   122.52771   -27.12198
   65    64 S   HA   _H23    61     1.08499   120.80142     1.01201
  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
