* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    112    173     328
    1     0 S   NP   _N1_     1    29.06003    96.78205   -22.01073
    2     1 S   H    _HN1     2     1.02871    43.31383   162.57048
    3     1 S   H    _H1_     3     1.02816    98.28236   -90.41315
    4     1 S   H    _H2_     4     1.02911    70.64121    15.93658
    5     1 S   CT   _CA1     5     1.50191   146.56107   114.81979
    6     5 S   HC   _HA1     6     1.09656   104.96941    93.72801
    7     5 S   CO3  _C1_     7     1.54010   111.31692   -24.54005
    8     7 S   O2Z  _O11     8     1.26188   115.69424   -80.04998
    9     7 S   O2Z  _O12     9     1.26408   114.58966    98.44278
   10     5 S   CT   _CB1    10     1.53203   107.16476  -149.92413
   11    10 S   HC   HB11    11     1.09843   109.24491   -52.01999
   12    10 S   HC   HB12    12     1.09780   110.74939    64.51408
   13    10 S   CT   _CG1    13     1.52986   112.34441  -172.82756
   14    13 S   HC   HG11    14     1.09503   110.55696   -67.04674
   15    13 S   HC   HG12    15     1.09675   109.73969    52.04062
   16    13 S   C    _CD1    16     1.51881   112.30021   172.59384
   17    16 S   O    _OE1    17     1.22722   123.26401     9.81995
   18    16 S   N    _N2_    18     1.38677   111.71631  -170.17955
   19    18 S   H    _HN2    19     1.01555   118.84587     1.55015
   20    18 S   CT1  _CA2    20     1.46360   123.53973   176.08413
   21    20 S   HC   _HA2    21     1.09726   109.46488     4.07290
   22    20 S   C    _C2_    22     1.53599   108.41516  -111.41354
   23    22 S   O    _O2_    23     1.23055   122.28919  -147.36577
   24    20 S   CT   _CB2    32     1.53312   111.34800   126.42107
   25    24 S   HC   HB21    33     1.09478   109.72509    54.64286
   26    24 S   HC   HB22    34     1.09510   110.77357   173.23868
   27    22 S   N    _N3_    24     1.38318   113.72284    39.95228
   28    27 S   H    _HN3    25     1.01568   119.60812    -2.86451
   29    24 S   S    _SG2    35     1.82780   111.34824   -67.62482
   30    27 S   CT   _CA3    26     1.45289   123.27957   177.36760
   31    30 S   HC   HA31    27     1.09546   107.45853   -66.13112
   32    30 S   HC   HA32    28     1.09555   108.06485    50.34354
   33    29 S   CT   _C12    36     1.82927    99.75874   156.80922
   34    33 S   HC   _H11    37     1.09444   109.14660    44.00251
   35    33 S   HC   _H12    38     1.09490   106.07156   160.42906
   36    30 S   CO3  _C3_    29     1.52979   114.02300   172.36354
   37    36 S   O2Z  _O31    30     1.26387   116.05479    -1.27472
   38    36 S   O2Z  _O32    31     1.26425   114.41850   178.80335
   39    33 S   CT   _C11    39     1.52616   111.29522   -79.50641
   40    39 S   HC   _H6_    40     1.09670   111.10994    50.90357
   41    39 S   CT   _C10    41     1.52413   115.00801   174.85871
   42    41 S   HC   _H5_    42     1.09328   112.86880   -79.03107
   43    41 S   CT   _C9_    43     1.51595   100.98938   160.24227
   44    43 S   F    F1__    44     1.35130   111.10565  -155.90955
   45    43 S   HC   _H4_    45     1.09572   110.91933    83.09489
   46    41 S   OH   _O35    61     1.42444   111.35721    42.34958
   47    46 S   HO   _H13    62     0.97241   108.78650    55.25524
   48    43 S   CO   _C8_    46     1.52508   102.89934   -36.72178
   49    48 S   HC   _H3_    47     1.09598   109.89301   -93.62993
   50    48 S   N*   _N4_    48     1.46794   113.38848   144.66962
   51    39 S   OS   _O34    60     1.44470   109.95317   -67.71398
   52    50 S   CNA  _C5_    49     1.37777   120.18961   -83.16715
   53    52 S   HC   _H8_    50     1.08295   117.84086     0.29342
   54    52 S   CM   _C4_    51     1.33046   121.93953  -179.80820
   55    54 S   HC   _H7_    52     1.08094   123.06673  -179.71061
   56    54 S   CDX  _C7_    53     1.48181   116.47382     1.00833
   57    56 S   NNC  _N5_    54     1.30484   121.81759    -3.29265
   58    56 S   NND  _N6_    57     1.37259   118.21192   176.58258
   59    58 S   H    _H9_    58     1.01649   121.72642    -6.34415
   60    58 S   H    _H10    59     1.01331   120.47877  -179.05333
   61    50 S   C    _C6_    55     1.40898   119.39159    94.23181
   62    61 S   O    _O33    56     1.23226   121.34896    -1.57172
  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   7   5   4   3
  10   5   4   2   1   1  12   6  10   7  10   6   5   3   1   9
   4   9   2   8   4   7   3   6   5   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    51  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    48    51    46  
   35    39    40    41    51  
   39    40    41    51  
   37    38  
   38  
    0  
   40    41    42    43    44    45    48    49    50    51    46    47  
   41    42    43    48    51    46  
   42    43    44    45    48    49    50    51    46    47  
   43    44    45    48    51    46    47  
   44    45    48    49    50    52    61    51    46    47  
   45    48    49    50    51    46  
   48    49    50    51    46  
   47    48    51  
    0  
   49    50    52    53    54    57    61    62    51  
   50    52    61    51  
   52    53    54    55    56    57    61    62    51  
   52    61  
   53    54    55    56    57    61    62    58  
   54    55    56    61  
   55    56    57    61    58    59    60  
   56    57    58  
   57    61    62    58    59    60  
   61    62    58    59    60  
   59    60    61  
   60  
    0  
   62  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.9400   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   45   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.8380   1.6250   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.480000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0500   0.100000   1.3810   1.2100   0.008598240   0.268726247
   50   3.2500   0.1700  -0.560000   1.8100   1.6000   0.054801302  -1.445846770
   51   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.5000   0.0800   0.100000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0800  -0.060000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0800   0.460000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.2500   0.1700  -0.540000   1.8375   1.6250   0.005000000   0.000000000
   58   3.2500   0.1700  -0.790000   1.8650   1.6500   0.051222218  -2.220205820
   59   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   60   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.7500   0.1050   0.550000   1.9250   1.7000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.480000   1.5250   1.4250   0.001000000  -1.480495490
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    51   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   320.000  1.410
   43    44   367.000  1.332
   43    45   340.000  1.090
   43    48   250.000  1.527
   48    49   340.000  1.090
   48    50   275.000  1.479
   48    51   320.000  1.380
   50    52   448.000  1.365
   50    61   418.000  1.388
   52    53   367.000  1.080
   52    54   549.000  1.340
   54    55   340.000  1.080
   54    56   427.000  1.433
   56    57   585.000  1.311
   56    58   481.000  1.340
   57    61   457.000  1.358
   61    62   570.000  1.229
   58    59   434.000  1.010
   58    60   434.000  1.010
   46    47   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    51    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    46    50.00000  109.50000
   39    51    48    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    50.00000  109.50000
   41    43    45    37.50000  110.70000
   41    43    48    75.00000  109.43000
   41    46    47    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    48    49    45.00000  112.01100
   43    48    50    75.00000  107.44000
   43    48    51    90.00000  108.56700
   45    43    44    40.00000  107.00000
   48    43    44    85.00000  108.48100
   48    43    45    45.00000  108.72000
   48    50    52    70.00000  121.20000
   48    50    61    70.00000  117.60000
   50    48    49    55.00000  103.44000
   50    52    53    35.00000  119.10000
   50    52    54    70.00000  121.20000
   50    61    57    70.00000  118.60000
   50    61    62    80.00000  120.60000
   52    54    55    35.00000  120.00000
   52    54    56    85.00000  117.00000
   54    52    53    35.00000  119.70000
   54    56    57    70.00000  121.02800
   54    56    58    70.00000  120.10000
   56    54    55    35.00000  123.30000
   56    57    61    70.00000  123.15400
   56    58    59    35.00000  120.00000
   56    58    60    35.00000  120.00000
   57    61    62    80.00000  122.50000
   61    50    52    70.00000  121.60000
   58    56    57    70.00000  119.30000
   60    58    59    35.00000  120.00000
   51    39    40    35.00000  109.50000
   51    39    41    50.00000  109.50000
   51    48    49    35.00000  109.50000
   51    48    50   105.00000  106.22000
   46    41    42    35.00000  109.50000
   46    41    43    50.00000  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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    51   0.56750  1.0 1.0
   29    33    39    51  -0.07550 -1.0 2.0
   29    33    39    51   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    46   0.86500  1.0 1.0
   33    39    41    46  -0.17500 -1.0 2.0
   33    39    41    46   0.20800  1.0 3.0
   33    39    51    48   0.06250  1.0 1.0
   33    39    51    48  -0.01100 -1.0 2.0
   33    39    51    48   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    51   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    51   0.23400  1.0 3.0
   39    41    43    44   0.39650  1.0 1.0
   39    41    43    44  -0.18350 -1.0 2.0
   39    41    43    44   0.41450  1.0 3.0
   39    41    43    45   0.15000  1.0 3.0
   39    41   -43    48   3.97050  1.0 1.0
   39    41    46    47  -0.11600  1.0 1.0
   39    41    46    47  -0.09450 -1.0 2.0
   39    41    46    47   0.21250  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    46   0.23400  1.0 3.0
   40    39    51    48   0.37050  1.0 3.0
   41    39   -51    48   0.06250  1.0 1.0
   41    39   -51    48  -0.01100 -1.0 2.0
   41    39   -51    48   0.28050  1.0 3.0
   41    43    48    49   0.15000  1.0 3.0
   41    43    48    50  -0.27100  1.0 1.0
   41    43    48    50  -0.01700 -1.0 2.0
   41    43    48    50  -0.48600  1.0 3.0
   41    43   -48    51   0.62750  1.0 1.0
   41    43   -48    51  -0.30950 -1.0 2.0
   41    43   -48    51   0.27300  1.0 3.0
   42    41    43    44   0.22100  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.15000  1.0 3.0
   42    41    46    47   0.19450  1.0 3.0
   43    41    46    47  -0.11600  1.0 1.0
   43    41    46    47  -0.09450 -1.0 2.0
   43    41    46    47   0.21250  1.0 3.0
   43    48    50    52   2.08450  1.0 1.0
   43    48    50    52  -0.39300 -1.0 2.0
   43    48    50    52   0.23400  1.0 3.0
   43    48    50    61  -0.43950  1.0 1.0
   43    48    50    61  -0.08100 -1.0 2.0
   43    48    50    61   0.03350  1.0 3.0
   43    48   -51    39   0.06250  1.0 1.0
   43    48   -51    39  -0.01100 -1.0 2.0
   43    48   -51    39   0.28050  1.0 3.0
   44    43    48    49   0.22100  1.0 3.0
   44    43    48    50   0.56750  1.0 1.0
   44    43    48    50  -0.07550 -1.0 2.0
   44    43    48    50   0.20000  1.0 3.0
   44    43    48    51   0.51850  1.0 1.0
   44    43    48    51  -0.72850 -1.0 2.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    50   0.15000  1.0 3.0
   45    43    48    51   0.23400  1.0 3.0
   48    50    52    53   1.88100 -1.0 2.0
   48    50    52    54  -0.88150  1.0 1.0
   48    50    52    54   2.95600 -1.0 2.0
   48    50    61    57   3.62500 -1.0 2.0
   48    50    61    62   3.04450 -1.0 2.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    61   0.00000  1.0 1.0
   49    48    51    39   0.37050  1.0 3.0
   50    48    51    39  -2.37750  1.0 1.0
   50    48    51    39  -0.08150 -1.0 2.0
   50    48    51    39   0.59000  1.0 3.0
   50    52    54    55   0.97550 -1.0 2.0
   50    52    54    56   7.00000 -1.0 2.0
   52    50    61    57   3.62500 -1.0 2.0
   52    50    61    62   2.67200 -1.0 2.0
   52    54   -56    57   7.00000 -1.0 2.0
   52    54    56    58   7.00000 -1.0 2.0
   53    52    54    55   7.00000 -1.0 2.0
   53    52    54    56   7.00000 -1.0 2.0
   54    56    57    61   3.62500 -1.0 2.0
   54    56    58    59   0.70000 -1.0 2.0
   54    56    58    60   0.70000 -1.0 2.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    58   7.00000 -1.0 2.0
   56    57   -61    50   3.62500 -1.0 2.0
   56    57    61    62   3.04450 -1.0 2.0
   57    56    58    59   0.70000 -1.0 2.0
   57    56    58    60   0.70000 -1.0 2.0
   61    50    52    53   1.44600  1.0 1.0
   61    50   -52    54  -0.18900  1.0 1.0
   61    50   -52    54   1.70900 -1.0 2.0
   58    56    57    61   3.62500 -1.0 2.0
   51    39    41    42   0.23400  1.0 3.0
   51    39   -41    43   0.62750  1.0 1.0
   51    39   -41    43  -0.30950 -1.0 2.0
   51    39   -41    43   0.27300  1.0 3.0
   51    39    41    46   3.69350  1.0 1.0
   51    39    41    46  -1.82950 -1.0 2.0
   51    48    50    52  -0.28000  1.0 1.0
   51    48    50    52  -1.16550 -1.0 2.0
   51    48    50    61  -2.75650  1.0 1.0
   51    48    50    61  -1.18150 -1.0 2.0
   51    48    50    61   0.81900  1.0 3.0
   46    41    43    44   1.44150  1.0 1.0
   46    41    43    44  -0.96950 -1.0 2.0
   46    41    43    44   0.13600  1.0 3.0
   46    41    43    45   0.23400  1.0 3.0
   46    41    43    48   0.86500  1.0 1.0
   46    41    43    48  -0.17500 -1.0 2.0
   46    41    43    48   0.20800  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
   37    30    36    38  10.50000 -1.0 2.0
   52    61    50    48   1.00000 -1.0 2.0
   50    53    52    54   1.10000 -1.0 2.0
   56    55    54    52   1.10000 -1.0 2.0
   58    54    56    57  10.50000 -1.0 2.0
   50    57    61    62  10.50000 -1.0 2.0
   60    56    58    59   1.00000 -1.0 2.0
END
