* LIGAND DATABASE FILE (OPLS2005)
*
001      66    65    117    163     337
    1     0 S   NP   _N1_     1    28.89651    93.64512   -19.88843
    2     1 S   H    _HN1     2     1.02878   102.72656    21.97966
    3     1 S   H    _H1_     3     1.02946    36.18959   124.04644
    4     1 S   H    _H2_     4     1.02807    75.47209   -83.72090
    5     1 S   CT   _CA1     5     1.50333   139.65947   169.24920
    6     5 S   HC   _HA1     6     1.09682   104.83550    35.95602
    7     5 S   CO3  _C1_     7     1.54441   110.93594   -80.72678
    8     7 S   O2Z  _O11     8     1.26147   116.61621  -107.74030
    9     7 S   O2Z  _O12     9     1.26475   113.91193    70.92223
   10     5 S   CT   _CB1    10     1.53072   107.20147   152.14963
   11    10 S   HC   HB11    11     1.09820   110.17282   -45.12225
   12    10 S   HC   HB12    12     1.09797   110.06956    71.50995
   13    10 S   CT   _CG1    13     1.53094   112.08938  -165.79868
   14    13 S   HC   HG11    14     1.09434   110.57593   -47.09814
   15    13 S   HC   HG12    15     1.09607   110.18053    71.55596
   16    13 S   C    _CD1    16     1.51702   111.64096  -168.38382
   17    16 S   O    _OE1    17     1.22766   122.86383   -23.36405
   18    16 S   N    _N2_    18     1.38545   112.02354   157.32058
   19    18 S   H    _HN2    19     1.01549   119.16569     3.18143
   20    18 S   CT1  _CA2    20     1.46214   123.29195  -175.53494
   21    20 S   HC   _HA2    21     1.09709   109.40494   -16.02242
   22    20 S   C    _C2_    22     1.53356   108.11447  -132.09062
   23    22 S   O    _O2_    23     1.23007   122.28226  -144.71986
   24    20 S   CT   _CB2    32     1.53570   111.43938   106.08700
   25    24 S   HC   HB21    33     1.09338   109.41061    58.20684
   26    24 S   HC   HB22    34     1.09526   110.33827   176.59912
   27    22 S   N    _N3_    24     1.38503   113.33088    42.35710
   28    27 S   H    _HN3    25     1.01531   118.95096    -0.10653
   29    24 S   S    _SG2    35     1.82713   112.23763   -63.36643
   30    27 S   CT   _CA3    26     1.45434   123.31017   175.43958
   31    30 S   HC   HA31    27     1.09533   109.08408    27.22230
   32    30 S   HC   HA32    28     1.09492   107.15750   144.19687
   33    29 S   CT   _C10    36     1.82635    99.88546   169.18389
   34    33 S   HC   _H18    37     1.09584   107.21002   165.22287
   35    33 S   HC   _H19    38     1.09510   108.81178    49.93607
   36    30 S   CO3  _C3_    29     1.52930   113.21362   -96.15229
   37    36 S   O2Z  _O31    30     1.26393   115.44635   -43.51274
   38    36 S   O2Z  _O32    31     1.26361   114.94970   137.41989
   39    33 S   CT   _C9_    39     1.53033   113.91959   -73.44097
   40    39 S   HC   _H16    40     1.09584   108.29234  -179.79252
   41    39 S   HC   _H17    41     1.09441   110.73831    63.45981
   42    39 S   NX   _N5_    42     1.46110   112.28918   -59.68022
   43    42 S   H    _H15    43     1.01901   109.18844    45.62425
   44    42 S   P1   _P1_    44     1.65794   118.91134  -178.32719
   45    44 S   O2Z  _O35    45     1.50954   114.01282    53.88567
   46    44 S   NX   _N4_    46     1.65777   105.31539  -179.96574
   47    46 S   H    _H10    47     1.02231   115.52189    49.22424
   48    44 S   OS   _O34    55     1.62863   106.42178   -66.91414
   49    46 S   CT   _C7_    48     1.46100   118.91614  -177.99240
   50    49 S   HC   _H11    49     1.09567   109.40590   -65.08762
   51    49 S   HC   _H12    50     1.09575   109.28880    52.67914
   52    48 S   CT   _C6_    56     1.42022   121.12570   -59.17511
   53    52 S   HC   _H8_    57     1.09353   108.87268   -68.75084
   54    52 S   HC   _H9_    58     1.09325   109.98803    50.39637
   55    49 S   CT   _C8_    51     1.52260   110.32862   173.41715
   56    55 S   Cl   Cl1_    52     1.78015   110.30312  -179.31815
   57    55 S   HC   _H13    53     1.09358   111.57541    61.34696
   58    55 S   HC   _H14    54     1.09461   111.30542   -60.02336
   59    52 S   CT   _C4_    59     1.52183   109.63371   171.85628
   60    59 S   HC   _H3_    60     1.09658   109.73246   174.61017
   61    59 S   HC   _H4_    61     1.09716   109.88788    57.94121
   62    59 S   CT   _C5_    62     1.52295   112.55772   -63.21554
   63    62 S   HC   _H5_    63     1.09340   110.79245   -59.40899
   64    62 S   HC   _H6_    64     1.09434   111.34399    62.12849
   65    62 S   OH   _O33    65     1.42124   108.78282  -178.35551
   66    65 S   HO   _H7_    66     0.97258   107.06028   179.17173
  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
   8   5   4   2   1   1   8   4   3   8   4  12   5  10   5   8
   6   5   4   9   5   4   3   2   1   1   7   5   4   4   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    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    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48  
   41    42    43    44  
   42    43    44  
   43    44    45    46    47    49    48    52  
   44    45    46    48  
   45    46    47    49    50    51    55    48    52    53    54    59  
   46    47    49    48    52  
   47    49    50    51    55    56    57    58    48    52  
   49    50    51    55    48  
   52    53    54    59    60    61    62    49  
   50    51    55    56    57    58  
   51    55    56    57    58  
   55    56    57    58  
   53    54    59    60    61    62    63    64    65  
   54    59    60    61    62  
   59    60    61    62  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63    64    65    66  
   61    62    63    64    65  
   62    63    64    65  
   63    64    65    66  
   64    65    66  
   65    66  
   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   0.047500   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  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   44   3.7400   0.2000   1.279300   2.1070   1.8700   0.005000000   0.000000000
   45   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   46   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   47   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   48   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5000   0.0660  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   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    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   340.000  1.090
   39    42   310.000  1.452
   42    43   505.000  1.018
   42    44   305.000  1.702
   44    45   675.000  1.490
   44    46   305.000  1.702
   44    48   405.000  1.623
   46    47   505.000  1.018
   46    49   310.000  1.452
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   245.000  1.781
   55    57   340.000  1.090
   55    58   340.000  1.090
   48    52   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   320.000  1.410
   65    66   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    37.50000  110.70000
   33    39    42    75.00000  110.98300
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    50.00000  108.89700
   39    42    44    60.00000  116.07500
   41    39    40    33.00000  107.80000
   42    39    40    50.00000  110.67200
   42    39    41    50.00000  110.67200
   42    44    45    85.00000  116.90400
   42    44    46    90.00000  104.15300
   42    44    48   105.00000  102.60700
   44    42    43    40.00000  115.80200
   44    46    47    40.00000  115.80200
   44    46    49    60.00000  116.07500
   44    48    52    75.00000  119.24600
   46    44    45    85.00000  116.90400
   46    49    50    50.00000  110.67200
   46    49    51    50.00000  110.67200
   46    49    55    75.00000  110.98300
   49    46    47    50.00000  108.89700
   49    55    56    69.00000  109.80000
   49    55    57    37.50000  110.70000
   49    55    58    37.50000  110.70000
   51    49    50    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   57    55    56    51.00000  107.60000
   58    55    56    51.00000  107.60000
   58    55    57    33.00000  107.80000
   48    44    45   100.00000  115.86100
   48    44    46   105.00000  102.60700
   48    52    53    35.00000  109.50000
   48    52    54    35.00000  109.50000
   48    52    59    50.00000  109.50000
   52    59    60    37.50000  110.70000
   52    59    61    37.50000  110.70000
   52    59    62    58.35000  112.70000
   54    52    53    33.00000  107.80000
   59    52    53    37.50000  110.70000
   59    52    54    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    64    37.50000  110.70000
   59    62    65    50.00000  109.50000
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    65    66    55.00000  108.50000
   64    62    63    33.00000  107.80000
   65    62    63    35.00000  109.50000
   65    62    64    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    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   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    42    43   0.14900  1.0 1.0
   33    39    42    43  -0.14450 -1.0 2.0
   33    39    42    43  -0.19400  1.0 3.0
   33    39    42    44  -2.23400  1.0 1.0
   33    39    42    44  -0.50500 -1.0 2.0
   33    39    42    44   0.66300  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    42   0.15000  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    42   0.15000  1.0 3.0
   39    42    44    45   0.00000  1.0 1.0
   39    42    44    46   0.50000  1.0 3.0
   39    42    44    48   0.29300  1.0 1.0
   39    42    44    48  -1.33650 -1.0 2.0
   39    42    44    48   0.62200  1.0 3.0
   40    39    42    43   0.20000  1.0 3.0
   40    39    42    44   0.05900  1.0 3.0
   41    39    42    43   0.20000  1.0 3.0
   41    39    42    44   0.05900  1.0 3.0
   42    44    46    47   0.50000  1.0 3.0
   42    44    46    49   0.50000  1.0 3.0
   42    44    48    52  -0.14600  1.0 1.0
   42    44    48    52  -0.87400 -1.0 2.0
   42    44    48    52   0.68500  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.50000  1.0 3.0
   43    42    44    48   0.07350  1.0 1.0
   43    42    44    48  -1.26400 -1.0 2.0
   43    42    44    48   0.45050  1.0 3.0
   44    46    49    50   0.05900  1.0 3.0
   44    46    49    51   0.05900  1.0 3.0
   44    46    49    55  -2.23400  1.0 1.0
   44    46    49    55  -0.50500 -1.0 2.0
   44    46    49    55   0.66300  1.0 3.0
   44    48    52    53   0.03000  1.0 3.0
   44    48    52    54   0.03000  1.0 3.0
   44    48    52    59  -2.65550  1.0 1.0
   44    48    52    59  -0.22350 -1.0 2.0
   44    48    52    59   0.24150  1.0 3.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    49   0.00000  1.0 1.0
   45    44    48    52   0.00000  1.0 1.0
   46    44    48    52  -0.14600  1.0 1.0
   46    44    48    52  -0.87400 -1.0 2.0
   46    44    48    52   0.68500  1.0 3.0
   46    49    55    56   0.56750  1.0 1.0
   46    49    55    56  -0.07550 -1.0 2.0
   46    49    55    56   0.20000  1.0 3.0
   46    49    55    57   0.15000  1.0 3.0
   46    49    55    58   0.15000  1.0 3.0
   47    46    49    50   0.20000  1.0 3.0
   47    46    49    51   0.20000  1.0 3.0
   47    46    49    55   0.14900  1.0 1.0
   47    46    49    55  -0.14450 -1.0 2.0
   47    46    49    55  -0.19400  1.0 3.0
   50    49    55    56   0.27000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    58   0.15000  1.0 3.0
   51    49    55    56   0.27000  1.0 3.0
   51    49    55    57   0.15000  1.0 3.0
   51    49    55    58   0.15000  1.0 3.0
   48    44    46    47   0.07350  1.0 1.0
   48    44    46    47  -1.26400 -1.0 2.0
   48    44    46    47   0.45050  1.0 3.0
   48    44    46    49   0.29300  1.0 1.0
   48    44    46    49  -1.33650 -1.0 2.0
   48    44    46    49   0.62200  1.0 3.0
   48    52    59    60   0.23400  1.0 3.0
   48    52    59    61   0.23400  1.0 3.0
   48    52    59    62   0.62750  1.0 1.0
   48    52    59    62  -0.30950 -1.0 2.0
   48    52    59    62   0.27300  1.0 3.0
   52    59    62    63   0.15000  1.0 3.0
   52    59    62    64   0.15000  1.0 3.0
   52    59    62    65   0.86500  1.0 1.0
   52    59    62    65  -0.17500 -1.0 2.0
   52    59    62    65   0.20800  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    61   0.15000  1.0 3.0
   53    52    59    62   0.15000  1.0 3.0
   54    52    59    60   0.15000  1.0 3.0
   54    52    59    61   0.15000  1.0 3.0
   54    52    59    62   0.15000  1.0 3.0
   59    62    65    66  -0.11600  1.0 1.0
   59    62    65    66  -0.09450 -1.0 2.0
   59    62    65    66   0.21250  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    64   0.15000  1.0 3.0
   60    59    62    65   0.23400  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    64   0.15000  1.0 3.0
   61    59    62    65   0.23400  1.0 3.0
   63    62    65    66   0.19450  1.0 3.0
   64    62    65    66   0.19450  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   43    44    42    39   1.00000 -1.0 2.0
   47    44    46    49   1.00000 -1.0 2.0
END
