* LIGAND DATABASE FILE (OPLS2005)
*
001      57    60    116    194     333
    1     0 S   NP   _N1_     1    28.58561    94.44619   -22.40655
    2     1 S   H    _HN1     2     1.02776    98.32360   -76.02004
    3     1 S   H    _H1_     3     1.02961    87.04502    32.08269
    4     1 S   H    _H2_     4     1.02834    26.96861   170.54177
    5     1 S   CT   _CA1     5     1.50116   136.36928   148.90600
    6     5 S   HC   _HA1     6     1.09575   105.23742    69.44018
    7     5 S   CO3  _C1_     7     1.53783   112.39348   -50.77336
    8     7 S   O2Z  _O11     8     1.26356   114.99921   -43.76332
    9     7 S   O2Z  _O12     9     1.26238   114.91794   135.43067
   10     5 S   CT   _CB1    10     1.53095   107.42695  -172.65276
   11    10 S   HC   HB11    11     1.09824   109.32171   -50.95875
   12    10 S   HC   HB12    12     1.09820   110.41439    65.58406
   13    10 S   CT   _CG1    13     1.53004   112.68440  -172.07925
   14    13 S   HC   HG11    14     1.09601   110.42428   -63.81871
   15    13 S   HC   HG12    15     1.09650   110.00678    55.41052
   16    13 S   C    _CD1    16     1.51810   112.32187   175.75361
   17    16 S   O    _OE1    17     1.22719   123.28343    -2.71527
   18    16 S   N    _N2_    18     1.38627   111.62713   177.45240
   19    18 S   H    _HN2    19     1.01596   118.99752     1.14124
   20    18 S   CT1  _CA2    20     1.46205   123.37768  -179.70261
   21    20 S   HC   _HA2    21     1.09735   109.42118   -10.18545
   22    20 S   C    _C2_    22     1.53450   108.35475  -125.84699
   23    22 S   O    _O2_    23     1.23019   122.17859  -145.86149
   24    20 S   CT   _CB2    32     1.53538   111.44627   111.95649
   25    24 S   HC   HB21    33     1.09302   109.22937    55.69626
   26    24 S   HC   HB22    34     1.09479   109.84887   174.56390
   27    22 S   N    _N3_    24     1.38480   113.41112    41.47011
   28    27 S   H    _HN3    25     1.01524   118.92901    -0.70249
   29    24 S   S    _SG2    35     1.82552   111.45661   -66.07530
   30    27 S   CT   _CA3    26     1.45463   123.54580   175.13232
   31    30 S   HC   HA31    27     1.09515   109.35766    21.81875
   32    30 S   HC   HA32    28     1.09499   107.08584   138.85106
   33    29 S   CT   _C12    36     1.82182   102.91468   170.56510
   34    30 S   CO3  _C3_    29     1.52924   113.05709  -101.73914
   35    34 S   O2Z  _O31    30     1.26407   115.39192   -44.25429
   36    34 S   O2Z  _O32    31     1.26352   114.98907   136.66224
   37    33 S   CM   _C11    37     1.53497   113.05513   155.61806
   38    37 S   Cl   Cl5_    38     1.69814   125.12337   -25.75513
   39    37 S   CM   _C10    39     1.33808   108.01417   157.59324
   40    39 S   Cl   Cl6_    40     1.69425   127.85761   178.21974
   41    39 S   CT   _C9_    41     1.51227   107.45407     0.35166
   42    41 S   Cl   Cl7_    42     1.75325   116.29433  -160.41001
   43    41 S   CT   _C5_    43     1.56724   108.61633    70.12263
   44    43 S   HC   _H4_    44     1.09771   109.60987   178.13628
   45    33 S   CT   _C13    55     1.57455   115.92589   -92.44568
   46    45 S   Cl   Cl3_    56     1.79399   115.23367    68.82488
   47    45 S   Cl   Cl4_    57     1.80703   114.85606   -54.98931
   48    33 S   CT   _C4_    45     1.56927   118.77559    29.23740
   49    48 S   HC   _H3_    46     1.09460   112.91932   -47.09868
   50    48 S   C3T  _C8_    47     1.49529   116.06994    81.21231
   51    50 S   HC   _H6_    48     1.07669   117.93795   -34.42138
   52    50 S   C3T  _C7_    49     1.49104   110.19308   115.51102
   53    52 S   Cl   Cl1_    50     1.74072   119.89206  -144.78797
   54    43 S   CT   _C6_    51     1.54692   117.09493    50.94118
   55    54 S   Cl   Cl2_    52     1.78555   111.21529   129.49909
   56    54 S   HC   _H5_    53     1.09247   111.96310    11.44878
   57    50 S   O3T  _O33    54     1.42954   114.79169   179.65965
  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  12   5   4   3
  18   2   1   1  12   5  10   4  13   7  14   8   6   2   1   9
   5   7   4   5   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    45    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    43    48    49    50    45    46    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    44    48    49    50    51    52    54    57    45    46    47  
   35    36  
   36  
    0  
   38    39    40    41    42    43    48    49    50    45    46    47  
   39    40    41    48    45  
   40    41    42    43    44    48    54    45    46    47  
   41    42    43    45  
   42    43    44    48    49    50    52    54    55    56    45    46    47  
   43    44    48    54    45    46    47  
   44    48    49    50    51    52    53    54    55    56    57    45    46    47  
   48    49    50    52    54    55    56    45  
   46    47    48    49    50    54  
   47    48  
   48  
   49    50    51    52    53    54    55    56    57  
   50    51    52    54    57  
   51    52    53    54    55    56    57  
   52    53    54    57  
   53    54    55    56    57  
   54    55    56    57  
   55    56    57  
   56    57  
   57  
    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   0.296100   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   47   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.397200   1.9750   1.7500   0.005000000  -0.741685710
   53   3.4000   0.3000  -0.221000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   56   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   57   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    48   268.000  1.529
   33    45   268.000  1.529
   37    38   300.000  1.725
   37    39   549.000  1.340
   39    40   300.000  1.725
   39    41   317.000  1.510
   41    42   245.000  1.781
   41    43   268.000  1.529
   41    45   268.000  1.529
   43    44   340.000  1.090
   43    48   268.000  1.529
   43    54   268.000  1.529
   48    49   340.000  1.090
   48    50   275.000  1.510
   50    51   340.000  1.088
   50    52   260.000  1.509
   50    57   335.000  1.432
   52    53   220.000  1.750
   52    54   275.000  1.510
   52    57   335.000  1.432
   54    55   245.000  1.781
   54    56   340.000  1.090
   45    46   245.000  1.781
   45    47   245.000  1.781
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    48    75.00000  111.63000
   29    33    45    75.00000  111.63000
   33    37    38    75.00000  111.02000
   33    37    39    70.00000  124.00000
   33    48    43    58.35000  112.70000
   33    48    49    37.50000  110.70000
   33    48    50    70.00000  112.37300
   33    45    41    58.35000  112.70000
   33    45    46    69.00000  109.80000
   33    45    47    69.00000  109.80000
   37    39    40    75.00000  121.50000
   37    39    41    70.00000  124.00000
   39    37    38    75.00000  121.50000
   39    41    42    75.00000  111.90500
   39    41    43    70.00000  112.02700
   39    41    45    70.00000  112.02700
   41    39    40    75.00000  111.02000
   41    43    44    37.50000  110.70000
   41    43    48    58.35000  112.70000
   41    43    54    58.35000  112.70000
   41    45    46    69.00000  109.80000
   41    45    47    69.00000  109.80000
   43    41    42    69.00000  109.80000
   43    48    49    37.50000  110.70000
   43    48    50    70.00000  112.37300
   43    54    52    70.00000  112.37300
   43    54    55    69.00000  109.80000
   43    54    56    37.50000  110.70000
   48    33    37    70.00000  112.02700
   48    43    44    37.50000  110.70000
   48    50    51    40.00000  115.04500
   48    50    52    60.00000  120.94000
   48    50    57    80.00000  116.47100
   50    48    49    45.00000  109.38400
   50    52    53    65.00000  117.97100
   50    52    54    60.00000  120.94000
   50    52    57    15.00000   60.43100
   50    57    52    15.00000   59.14900
   52    50    51    37.50000  117.20000
   52    54    55    69.00000  109.80000
   52    54    56    45.00000  109.38400
   54    43    44    37.50000  110.70000
   54    43    48    58.35000  112.70000
   54    52    53    69.00000  109.80000
   56    54    55    51.00000  107.60000
   57    50    51    50.00000  114.27700
   57    50    52    15.00000   60.43100
   57    52    53    95.00000  108.90000
   57    52    54    80.00000  116.47100
   45    33    37    70.00000  112.02700
   45    33    48    58.35000  112.70000
   45    41    42    69.00000  109.80000
   45    41    43    58.35000  112.70000
   47    45    46    80.00000  110.42200
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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    37    38   0.09700  1.0 1.0
   29    33    37    38   0.15600 -1.0 2.0
   29    33    37    38  -0.50800  1.0 3.0
   29    33    37    39   0.42700  1.0 1.0
   29    33    37    39  -0.70350 -1.0 2.0
   29    33    37    39  -0.43150  1.0 3.0
   29    33    48    43   0.44750  1.0 1.0
   29    33    48    43  -0.17800 -1.0 2.0
   29    33    48    43   0.20200  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    50   0.44750  1.0 1.0
   29    33    48    50  -0.17800 -1.0 2.0
   29    33    48    50   0.20200  1.0 3.0
   29    33    45    41   0.44750  1.0 1.0
   29    33    45    41  -0.17800 -1.0 2.0
   29    33    45    41   0.20200  1.0 3.0
   29    33    45    46   0.56750  1.0 1.0
   29    33    45    46  -0.07550 -1.0 2.0
   29    33    45    46   0.20000  1.0 3.0
   29    33    45    47   0.56750  1.0 1.0
   29    33    45    47  -0.07550 -1.0 2.0
   29    33    45    47   0.20000  1.0 3.0
   33    37    39    40   7.00000 -1.0 2.0
   33    37   -39    41   7.00000 -1.0 2.0
   33    48    50    51   0.15000  1.0 3.0
   33    48    50    52   0.07850  1.0 1.0
   33    48    50    52  -0.03950 -1.0 2.0
   33    48    50    52   0.67350  1.0 3.0
   33    48    50    57   0.02550  1.0 1.0
   33    48    50    57  -0.02600 -1.0 2.0
   33    48    50    57   1.20400  1.0 3.0
   37    33    48    43   0.34400  1.0 1.0
   37    33    48    43   0.09450 -1.0 2.0
   37    33    48    43   0.11100  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    50   0.34400  1.0 1.0
   37    33    48    50   0.09450 -1.0 2.0
   37    33    48    50   0.11100  1.0 3.0
   37    33   -45    41   0.34400  1.0 1.0
   37    33   -45    41   0.09450 -1.0 2.0
   37    33   -45    41   0.11100  1.0 3.0
   37    33    45    46   0.56750  1.0 1.0
   37    33    45    46  -0.07550 -1.0 2.0
   37    33    45    46   0.20000  1.0 3.0
   37    33    45    47   0.56750  1.0 1.0
   37    33    45    47  -0.07550 -1.0 2.0
   37    33    45    47   0.20000  1.0 3.0
   37    39    41    42   0.09700  1.0 1.0
   37    39    41    42   0.15600 -1.0 2.0
   37    39    41    42  -0.50800  1.0 3.0
   37    39   -41    43   0.09850  1.0 1.0
   37    39   -41    43   0.15250 -1.0 2.0
   37    39   -41    43  -0.50650  1.0 3.0
   37    39   -41    45   0.09850  1.0 1.0
   37    39   -41    45   0.15250 -1.0 2.0
   37    39   -41    45  -0.50650  1.0 3.0
   38    37    39    40   7.00000 -1.0 2.0
   38    37    39    41   7.00000 -1.0 2.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    48   0.34400  1.0 1.0
   39    41    43    48   0.09450 -1.0 2.0
   39    41    43    48   0.11100  1.0 3.0
   39    41    43    54   0.34400  1.0 1.0
   39    41    43    54   0.09450 -1.0 2.0
   39    41    43    54   0.11100  1.0 3.0
   39    41   -45    33   0.34400  1.0 1.0
   39    41   -45    33   0.09450 -1.0 2.0
   39    41   -45    33   0.11100  1.0 3.0
   39    41    45    46   0.56750  1.0 1.0
   39    41    45    46  -0.07550 -1.0 2.0
   39    41    45    46   0.20000  1.0 3.0
   39    41    45    47   0.56750  1.0 1.0
   39    41    45    47  -0.07550 -1.0 2.0
   39    41    45    47   0.20000  1.0 3.0
   40    39    41    42   0.09700  1.0 1.0
   40    39    41    42   0.15600 -1.0 2.0
   40    39    41    42  -0.50800  1.0 3.0
   40    39    41    43   0.09700  1.0 1.0
   40    39    41    43   0.15600 -1.0 2.0
   40    39    41    43  -0.50800  1.0 3.0
   40    39    41    45   0.09700  1.0 1.0
   40    39    41    45   0.15600 -1.0 2.0
   40    39    41    45  -0.50800  1.0 3.0
   41    43   -48    33   0.56750  1.0 1.0
   41    43   -48    33  -0.07550 -1.0 2.0
   41    43   -48    33   0.20000  1.0 3.0
   41    43    48    49   0.15000  1.0 3.0
   41    43    48    50   0.47050  1.0 1.0
   41    43    48    50   0.03900 -1.0 2.0
   41    43    48    50   0.20100  1.0 3.0
   41    43    54    52   0.47050  1.0 1.0
   41    43    54    52   0.03900 -1.0 2.0
   41    43    54    52   0.20100  1.0 3.0
   41    43    54    55   0.35600  1.0 1.0
   41    43    54    55  -0.14650 -1.0 2.0
   41    43    54    55   0.33350  1.0 3.0
   41    43    54    56   0.15000  1.0 3.0
   42    41    43    44   0.27000  1.0 3.0
   42    41    43    48   0.35600  1.0 1.0
   42    41    43    48  -0.14650 -1.0 2.0
   42    41    43    48   0.33350  1.0 3.0
   42    41    43    54   0.35600  1.0 1.0
   42    41    43    54  -0.14650 -1.0 2.0
   42    41    43    54   0.33350  1.0 3.0
   42    41    45    33   0.35600  1.0 1.0
   42    41    45    33  -0.14650 -1.0 2.0
   42    41    45    33   0.33350  1.0 3.0
   42    41    45    46   0.22500  1.0 1.0
   42    41    45    47   0.22500  1.0 1.0
   43    41   -45    33   0.56750  1.0 1.0
   43    41   -45    33  -0.07550 -1.0 2.0
   43    41   -45    33   0.20000  1.0 3.0
   43    41    45    46   0.35600  1.0 1.0
   43    41    45    46  -0.14650 -1.0 2.0
   43    41    45    46   0.33350  1.0 3.0
   43    41    45    47   0.35600  1.0 1.0
   43    41    45    47  -0.14650 -1.0 2.0
   43    41    45    47   0.33350  1.0 3.0
   43    48    50    51   0.15000  1.0 3.0
   43    48   -50    52   0.07850  1.0 1.0
   43    48   -50    52  -0.03950 -1.0 2.0
   43    48   -50    52   0.67350  1.0 3.0
   43    48    50    57   0.02550  1.0 1.0
   43    48    50    57  -0.02600 -1.0 2.0
   43    48    50    57   1.20400  1.0 3.0
   44    43    48    33   0.15000  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    54    52   0.15000  1.0 3.0
   44    43    54    55   0.27000  1.0 3.0
   44    43    54    56   0.15000  1.0 3.0
   48    33    37    38   0.09700  1.0 1.0
   48    33    37    38   0.15600 -1.0 2.0
   48    33    37    38  -0.50800  1.0 3.0
   48    33   -37    39   0.09850  1.0 1.0
   48    33   -37    39   0.15250 -1.0 2.0
   48    33   -37    39  -0.50650  1.0 3.0
   48    33   -45    41   0.56750  1.0 1.0
   48    33   -45    41  -0.07550 -1.0 2.0
   48    33   -45    41   0.20000  1.0 3.0
   48    33    45    46   0.35600  1.0 1.0
   48    33    45    46  -0.14650 -1.0 2.0
   48    33    45    46   0.33350  1.0 3.0
   48    33    45    47   0.35600  1.0 1.0
   48    33    45    47  -0.14650 -1.0 2.0
   48    33    45    47   0.33350  1.0 3.0
   48    43   -54    52   0.47050  1.0 1.0
   48    43   -54    52   0.03900 -1.0 2.0
   48    43   -54    52   0.20100  1.0 3.0
   48    43    54    55   0.35600  1.0 1.0
   48    43    54    55  -0.14650 -1.0 2.0
   48    43    54    55   0.33350  1.0 3.0
   48    43    54    56   0.15000  1.0 3.0
   48    50    52    53   0.35600  1.0 1.0
   48    50    52    53  -0.14650 -1.0 2.0
   48    50    52    53   0.33350  1.0 3.0
   48    50   -52    54   0.56750  1.0 1.0
   48    50   -52    54  -0.07550 -1.0 2.0
   48    50   -52    54   0.20000  1.0 3.0
   48    50   -52    57   0.02550  1.0 1.0
   48    50   -52    57  -0.02600 -1.0 2.0
   48    50   -52    57   1.20400  1.0 3.0
   48    50   -57    52   0.06250  1.0 1.0
   48    50   -57    52  -0.01100 -1.0 2.0
   48    50   -57    52   0.28050  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    52   0.15000  1.0 3.0
   49    48    50    57   0.23400  1.0 3.0
   50    52   -54    43   0.07850  1.0 1.0
   50    52   -54    43  -0.03950 -1.0 2.0
   50    52   -54    43   0.67350  1.0 3.0
   50    52    54    55   0.35600  1.0 1.0
   50    52    54    55  -0.14650 -1.0 2.0
   50    52    54    55   0.33350  1.0 3.0
   50    52    54    56   0.15000  1.0 3.0
   51    50    52    53   0.27000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50   -52    57   0.23400  1.0 3.0
   51    50   -57    52   0.36800  1.0 3.0
   53    52    54    43   0.35600  1.0 1.0
   53    52    54    43  -0.14650 -1.0 2.0
   53    52    54    43   0.33350  1.0 3.0
   53    52    54    55   0.22500  1.0 1.0
   53    52    54    56   0.27000  1.0 3.0
   53    52   -57    50   0.37500  1.0 3.0
   54    43    48    33   0.56750  1.0 1.0
   54    43    48    33  -0.07550 -1.0 2.0
   54    43    48    33   0.20000  1.0 3.0
   54    43    48    49   0.15000  1.0 3.0
   54    43   -48    50   0.47050  1.0 1.0
   54    43   -48    50   0.03900 -1.0 2.0
   54    43   -48    50   0.20100  1.0 3.0
   54    52   -57    50   0.06250  1.0 1.0
   54    52   -57    50  -0.01100 -1.0 2.0
   54    52   -57    50   0.28050  1.0 3.0
   57    50   -52    53   0.56750  1.0 1.0
   57    50   -52    53  -0.07550 -1.0 2.0
   57    50   -52    53   0.20000  1.0 3.0
   57    50   -52    54   0.02550  1.0 1.0
   57    50   -52    54  -0.02600 -1.0 2.0
   57    50   -52    54   1.20400  1.0 3.0
   57    52   -54    43   0.02550  1.0 1.0
   57    52   -54    43  -0.02600 -1.0 2.0
   57    52   -54    43   1.20400  1.0 3.0
   57    52    54    55   0.56750  1.0 1.0
   57    52    54    55  -0.07550 -1.0 2.0
   57    52    54    55   0.20000  1.0 3.0
   57    52    54    56   0.23400  1.0 3.0
   45    33    37    38   0.09700  1.0 1.0
   45    33    37    38   0.15600 -1.0 2.0
   45    33    37    38  -0.50800  1.0 3.0
   45    33   -37    39   0.09850  1.0 1.0
   45    33   -37    39   0.15250 -1.0 2.0
   45    33   -37    39  -0.50650  1.0 3.0
   45    33   -48    43   0.56750  1.0 1.0
   45    33   -48    43  -0.07550 -1.0 2.0
   45    33   -48    43   0.20000  1.0 3.0
   45    33    48    49   0.15000  1.0 3.0
   45    33    48    50   0.47050  1.0 1.0
   45    33    48    50   0.03900 -1.0 2.0
   45    33    48    50   0.20100  1.0 3.0
   45    41    43    44   0.15000  1.0 3.0
   45    41   -43    48   0.56750  1.0 1.0
   45    41   -43    48  -0.07550 -1.0 2.0
   45    41   -43    48   0.20000  1.0 3.0
   45    41    43    54   0.56750  1.0 1.0
   45    41    43    54  -0.07550 -1.0 2.0
   45    41    43    54   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    39   1.10000 -1.0 2.0
   41    40    39    37   1.10000 -1.0 2.0
END
