* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    111    167     327
    1     0 S   NP   _N1_     1    28.76748    95.28766   -21.30265
    2     1 S   H    _HN1     2     1.02837    33.68337   155.66550
    3     1 S   H    _H1_     3     1.02780    90.20173   -81.06761
    4     1 S   H    _H2_     4     1.02959    86.50790    27.28106
    5     1 S   CT   _CA1     5     1.50108   144.25896   148.16337
    6     5 S   HC   _HA1     6     1.09574   105.24276    63.62259
    7     5 S   CO3  _C1_     7     1.53795   112.38684   -56.60099
    8     7 S   O2Z  _O11     8     1.26356   114.99929   -44.11219
    9     7 S   O2Z  _O12     9     1.26238   114.92469   135.10793
   10     5 S   CT   _CB1    10     1.53102   107.43599  -178.46176
   11    10 S   HC   HB11    11     1.09820   109.36858   -50.81648
   12    10 S   HC   HB12    12     1.09820   110.41357    65.76434
   13    10 S   CT   _CG1    13     1.52976   112.62228  -171.93452
   14    13 S   HC   HG11    14     1.09553   110.34587   -62.97126
   15    13 S   HC   HG12    15     1.09645   110.04920    56.20529
   16    13 S   C    _CD1    16     1.51799   112.38994   176.58069
   17    16 S   O    _OE1    17     1.22708   123.26484    -5.14251
   18    16 S   N    _N2_    18     1.38596   111.54932   175.25245
   19    18 S   H    _HN2    19     1.01574   118.99416     1.36916
   20    18 S   CT1  _CA2    20     1.46282   123.53788  -178.85790
   21    20 S   HC   _HA2    21     1.09727   109.47224    -7.65873
   22    20 S   C    _C2_    22     1.53437   108.34576  -123.36075
   23    22 S   O    _O2_    23     1.23014   122.26442  -145.75208
   24    20 S   CT   _CB2    32     1.53333   111.09674   114.42602
   25    24 S   HC   HB21    33     1.09528   109.59379    55.55737
   26    24 S   HC   HB22    34     1.09508   110.81455   174.04491
   27    22 S   N    _N3_    24     1.38518   113.40241    41.60651
   28    27 S   H    _HN3    25     1.01516   118.90714    -0.70416
   29    24 S   S    _SG2    35     1.82829   111.40107   -66.66702
   30    27 S   CT   _CA3    26     1.45461   123.56831   175.17286
   31    30 S   HC   HA31    27     1.09513   109.38578    21.46683
   32    30 S   HC   HA32    28     1.09500   107.08489   138.49439
   33    29 S   CT   _C8_    36     1.83463    99.78704   149.89339
   34    33 S   HC   _H3_    37     1.09522   108.59825    36.01982
   35    30 S   CO3  _C3_    29     1.52917   113.01053  -102.11407
   36    35 S   O2Z  _O31    30     1.26410   115.36223   -45.22354
   37    35 S   O2Z  _O32    31     1.26348   115.00643   135.67914
   38    33 S   CM   _C4_    38     1.50520   108.72814   -81.89800
   39    38 S   HC   _H16    39     1.08726   115.81193    72.46143
   40    38 S   CM   _C5_    40     1.34763   125.11106  -109.26128
   41    40 S   CT   _C9_    41     1.51800   121.18432     1.91438
   42    41 S   HC   _H18    42     1.09740   108.10405  -114.42299
   43    40 S   CT   _C13    53     1.52458   122.29676  -176.61453
   44    43 S   HC   _H26    54     1.09809   108.30498   167.94197
   45    41 S   CT   _C10    43     1.54326   115.78619     8.82181
   46    45 S   HC   _H19    44     1.09687   110.12407    89.29519
   47    41 S   OH   _O13    51     1.43430   109.07113   130.57071
   48    47 S   HO   _H27    52     0.97266   107.50638   -61.29328
   49    43 S   CT   _C11    55     1.53059   111.16592   -74.10029
   50    49 S   HC   _H20    56     1.09554   111.59726    65.42078
   51    49 S   HC   _H21    57     1.09512   111.24108   -55.16012
   52    49 S   HC   _H22    58     1.09541   110.59124  -174.72578
   53    43 S   CT   _C12    59     1.53292   113.03422    50.77782
   54    53 S   HC   _H23    60     1.09511   112.17988   -68.18695
   55    53 S   HC   _H24    61     1.09570   110.32531   172.16181
   56    53 S   HC   _H25    62     1.09554   110.96242    52.94340
   57    33 S   CM   _C6_    45     1.50496   108.96287   155.24055
   58    45 S   OH   _O14    49     1.43053   107.41039  -155.65997
   59    58 S   HO   _H28    50     0.97484   106.97675   168.50397
   60    57 S   CMA  _C7_    46     1.51883   119.81175   -91.08419
   61    60 S   OM   _O33    47     1.26282   120.57477   122.33038
   62    60 S   OM   _O34    48     1.26215   120.67852   -58.10547
  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   8   5   4   3
  13   6   2   1   1  12   4  18  13   7  11   8   9   5   3   1
   7   3   2   1   3   2   1   1   5   2   1   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    57    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    57    60  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    46    57    60    61    62    58    43  
   38    39    40    45    57    60  
   36    37  
   37  
    0  
   39    40    41    42    45    57    60    47    43    44    49    53  
   40    41    57    43  
   41    42    45    46    57    58    47    48    43    44    49    50    51    52    53    54    55    56  
   42    45    46    57    60    58    59    47    48    43    44    49    53  
   45    46    57    58    47    48    43  
   44    49    50    51    52    53    54    55    56    45    47  
   49    50    51    52    53    54    55    56  
   46    57    60    61    62    58    59    47    48  
   57    60    58    59    47  
   48    57    58  
    0  
   50    51    52    53    54    55    56  
   51    52    53  
   52    53  
   53  
   54    55    56  
   55    56  
   56  
    0  
   60    61    62    58    59  
   59    60  
    0  
   61    62  
   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   0.107500   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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  -0.060000   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   62   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
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   317.000  1.510
   33    57   317.000  1.510
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   317.000  1.510
   40    43   317.000  1.510
   41    42   340.000  1.090
   41    45   268.000  1.529
   41    47   320.000  1.410
   45    46   340.000  1.090
   45    57   317.000  1.510
   45    58   320.000  1.410
   57    60   465.000  1.376
   60    61   745.000  1.250
   60    62   745.000  1.250
   58    59   553.000  0.945
   47    48   553.000  0.945
   43    44   340.000  1.090
   43    49   268.000  1.529
   43    53   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
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  112.20000
   29    33    57    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    57    45    65.00000  117.92700
   33    57    60    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    40    41    70.00000  124.00000
   38    40    43    70.00000  124.00000
   40    38    39    35.00000  120.00000
   40    41    42    35.00000  109.50000
   40    41    45    70.00000  112.02700
   40    41    47    90.00000  110.39200
   40    43    44    35.00000  109.50000
   40    43    49    70.00000  112.02700
   40    43    53    70.00000  112.02700
   41    45    46    37.50000  110.70000
   41    45    57    70.00000  112.02700
   41    45    58    50.00000  109.50000
   41    47    48    55.00000  108.50000
   45    41    42    37.50000  110.70000
   45    57    60    70.00000  124.00000
   45    58    59    55.00000  108.50000
   57    33    34    35.00000  109.50000
   57    33    38    70.00000  110.12100
   57    45    46    35.00000  109.50000
   57    60    61    65.00000  137.10300
   57    60    62    65.00000  137.10300
   62    60    61    65.00000  121.00000
   58    45    46    35.00000  109.50000
   58    45    57    90.00000  110.39200
   47    41    42    35.00000  109.50000
   47    41    45    50.00000  109.50000
   43    40    41    65.00000  117.92700
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    52    37.50000  110.70000
   43    53    54    37.50000  110.70000
   43    53    55    37.50000  110.70000
   43    53    56    37.50000  110.70000
   49    43    44    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    43    44    37.50000  110.70000
   53    43    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    57  -0.62250  1.0 1.0
   24    29    33    57  -0.38450 -1.0 2.0
   24    29    33    57   0.81900  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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    57    45   0.30250  1.0 1.0
   29    33    57    45  -0.14950 -1.0 2.0
   29    33    57    45   0.36900  1.0 3.0
   29    33    57    60   0.42700  1.0 1.0
   29    33    57    60  -0.70350 -1.0 2.0
   29    33    57    60  -0.43150  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    43   7.00000 -1.0 2.0
   33    57    60    61   7.00000 -1.0 2.0
   33    57    60    62   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    57    45   0.34800  1.0 3.0
   34    33    57    60   0.00000  1.0 1.0
   38    33    57    45   0.09700  1.0 1.0
   38    33    57    45   0.15600 -1.0 2.0
   38    33    57    45  -0.50800  1.0 3.0
   38    33    57    60  -0.28300  1.0 1.0
   38    33    57    60   0.26700 -1.0 2.0
   38    33    57    60  -0.63300  1.0 3.0
   38    40    41    42   0.00000  1.0 1.0
   38    40   -41    45   0.09850  1.0 1.0
   38    40   -41    45   0.15250 -1.0 2.0
   38    40   -41    45  -0.50650  1.0 3.0
   38    40    41    47   0.67800  1.0 1.0
   38    40    41    47   0.47050 -1.0 2.0
   38    40    41    47  -0.62500  1.0 3.0
   38    40    43    44   0.00000  1.0 1.0
   38    40    43    49   0.09850  1.0 1.0
   38    40    43    49   0.15250 -1.0 2.0
   38    40    43    49  -0.50650  1.0 3.0
   38    40    43    53   0.09850  1.0 1.0
   38    40    43    53   0.15250 -1.0 2.0
   38    40    43    53  -0.50650  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    43   7.00000 -1.0 2.0
   40    41    45    46   0.15000  1.0 3.0
   40    41    45    57   0.31000  1.0 1.0
   40    41    45    57   0.14700 -1.0 2.0
   40    41    45    57   0.07550  1.0 3.0
   40    41    45    58   1.05650  1.0 1.0
   40    41    45    58   0.15600 -1.0 2.0
   40    41    45    58   0.53150  1.0 3.0
   40    41    47    48  -0.07800  1.0 1.0
   40    41    47    48  -0.21500 -1.0 2.0
   40    41    47    48  -0.03150  1.0 3.0
   40    43    49    50   0.15000  1.0 3.0
   40    43    49    51   0.15000  1.0 3.0
   40    43    49    52   0.15000  1.0 3.0
   40    43    53    54   0.15000  1.0 3.0
   40    43    53    55   0.15000  1.0 3.0
   40    43    53    56   0.15000  1.0 3.0
   41    40    43    44   0.34800  1.0 3.0
   41    40    43    49   0.46850  1.0 1.0
   41    40    43    49   0.08550 -1.0 2.0
   41    40    43    49   0.09800  1.0 3.0
   41    40    43    53   0.46850  1.0 1.0
   41    40    43    53   0.08550 -1.0 2.0
   41    40    43    53   0.09800  1.0 3.0
   41    45   -57    33   0.46850  1.0 1.0
   41    45   -57    33   0.08550 -1.0 2.0
   41    45   -57    33   0.09800  1.0 3.0
   41    45    57    60   0.09850  1.0 1.0
   41    45    57    60   0.15250 -1.0 2.0
   41    45    57    60  -0.50650  1.0 3.0
   41    45    58    59  -0.11600  1.0 1.0
   41    45    58    59  -0.09450 -1.0 2.0
   41    45    58    59   0.21250  1.0 3.0
   42    41    45    46   0.15000  1.0 3.0
   42    41    45    57   0.15000  1.0 3.0
   42    41    45    58   0.23400  1.0 3.0
   42    41    47    48   0.19450  1.0 3.0
   45    41    47    48  -0.11600  1.0 1.0
   45    41    47    48  -0.09450 -1.0 2.0
   45    41    47    48   0.21250  1.0 3.0
   45    57    60    61   7.00000 -1.0 2.0
   45    57    60    62   7.00000 -1.0 2.0
   46    45    57    33   0.34800  1.0 3.0
   46    45    57    60   0.00000  1.0 1.0
   46    45    58    59   0.19450  1.0 3.0
   57    33    38    39   0.00000  1.0 1.0
   57    33   -38    40  -0.28300  1.0 1.0
   57    33   -38    40   0.26700 -1.0 2.0
   57    33   -38    40  -0.63300  1.0 3.0
   57    45    58    59  -0.07800  1.0 1.0
   57    45    58    59  -0.21500 -1.0 2.0
   57    45    58    59  -0.03150  1.0 3.0
   58    45    57    33   0.18000  1.0 1.0
   58    45    57    33   0.16450 -1.0 2.0
   58    45    57    33   0.04450  1.0 3.0
   58    45    57    60   0.67800  1.0 1.0
   58    45    57    60   0.47050 -1.0 2.0
   58    45    57    60  -0.62500  1.0 3.0
   47    41    45    46   0.23400  1.0 3.0
   47    41    45    57   1.05650  1.0 1.0
   47    41    45    57   0.15600 -1.0 2.0
   47    41    45    57   0.53150  1.0 3.0
   47    41    45    58   3.75450  1.0 1.0
   43    40    41    42   0.34800  1.0 3.0
   43    40    41    45   0.46850  1.0 1.0
   43    40    41    45   0.08550 -1.0 2.0
   43    40    41    45   0.09800  1.0 3.0
   43    40    41    47   0.18000  1.0 1.0
   43    40    41    47   0.16450 -1.0 2.0
   43    40    41    47   0.04450  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    52   0.15000  1.0 3.0
   44    43    53    54   0.15000  1.0 3.0
   44    43    53    55   0.15000  1.0 3.0
   44    43    53    56   0.15000  1.0 3.0
   49    43    53    54   0.15000  1.0 3.0
   49    43    53    55   0.15000  1.0 3.0
   49    43    53    56   0.15000  1.0 3.0
   53    43    49    50   0.15000  1.0 3.0
   53    43    49    51   0.15000  1.0 3.0
   53    43    49    52   0.15000  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
   33    39    38    40   1.10000 -1.0 2.0
   41    43    40    38   1.10000 -1.0 2.0
   33    45    57    60   1.10000 -1.0 2.0
   61    62    60    57   1.10000 -1.0 2.0
END
