* LIGAND DATABASE FILE (OPLS2005)
*
001      60    61    115    182     332
    1     0 S   NP   _N1_     1    28.00718    96.54923   -23.59760
    2     1 S   H    _HN1     2     1.02779   109.47456  -115.76645
    3     1 S   H    _H1_     3     1.02956    77.81510   -10.41492
    4     1 S   H    _H2_     4     1.02837    30.69973   151.81882
    5     1 S   CT   _CA1     5     1.50157   131.51017    96.16119
    6     5 S   HC   _HA1     6     1.09578   105.17867    86.06449
    7     5 S   CO3  _C1_     7     1.53749   112.22739   -34.04262
    8     7 S   O2Z  _O11     8     1.26366   114.99275   -46.35744
    9     7 S   O2Z  _O12     9     1.26221   114.90342   132.45470
   10     5 S   CT   _CB1    10     1.53069   107.38615  -156.13431
   11    10 S   HC   HB11    11     1.09836   109.22739   -50.52096
   12    10 S   HC   HB12    12     1.09813   110.48690    65.97988
   13    10 S   CT   _CG1    13     1.53069   112.75331  -171.56017
   14    13 S   HC   HG11    14     1.09585   110.57580   -66.27122
   15    13 S   HC   HG12    15     1.09660   109.85960    52.97701
   16    13 S   C    _CD1    16     1.51873   112.08581   173.27713
   17    16 S   O    _OE1    17     1.22794   123.18807     4.90888
   18    16 S   N    _N2_    18     1.38577   111.94309  -174.99128
   19    18 S   H    _HN2    19     1.01574   119.21635     2.81056
   20    18 S   CT1  _CA2    20     1.45797   122.60221   176.98565
   21    20 S   HC   _HA2    21     1.09746   108.73695    28.11322
   22    20 S   C    _C2_    22     1.53016   107.12989   -88.76348
   23    22 S   O    _O2_    23     1.22971   123.15237   -26.07670
   24    20 S   CT   _CB2    32     1.53152   112.58486   151.30553
   25    24 S   HC   HB21    33     1.09603   110.45930    54.11133
   26    24 S   HC   HB22    34     1.09469   109.94459   172.87079
   27    22 S   N    _N3_    24     1.38525   112.49488   156.52975
   28    27 S   H    _HN3    25     1.01653   120.31224    -2.14009
   29    24 S   S    _SG2    35     1.82488   111.37969   -66.49612
   30    27 S   CT   _CA3    26     1.45348   122.54433   178.59946
   31    30 S   HC   HA31    27     1.09566   107.87279   -54.54939
   32    30 S   HC   HA32    28     1.09559   107.56749    61.80851
   33    29 S   CT   _C11    36     1.84234    99.07593  -173.51251
   34    33 S   HC   _H5_    37     1.09542   106.74728   -41.28850
   35    30 S   CO3  _C3_    29     1.52897   114.27512  -176.47441
   36    35 S   O2Z  _O31    30     1.26343   116.04555     0.35332
   37    35 S   O2Z  _O32    31     1.26431   114.41928  -179.70261
   38    33 S   CM   _C9_    38     1.51660   108.22128  -159.13410
   39    38 S   C4T  _C8_    39     1.50123   116.62839  -112.74294
   40    39 S   HC   _H4_    40     1.09390   113.93280   170.99641
   41    38 S   CMA  _C10    58     1.51935   122.09178    78.57777
   42    41 S   OM   _O33    59     1.26273   121.03042    41.69687
   43    41 S   OM   _O34    60     1.26264   120.53158  -138.47645
   44    39 S   C4T  _C7_    41     1.56510   110.69751    40.19053
   45    44 S   HC   _H9_    42     1.09424   117.39427    36.88945
   46    44 S   HC   _H10    43     1.09531   115.22558   163.26845
   47    39 S   C4T  _C5_    49     1.58673   113.05015   -54.64950
   48    44 S   C4T  _C6_    44     1.55746    84.95233   -80.93925
   49    48 S   HC   _H3_    45     1.09528   114.95203  -148.16264
   50    47 S   CT   _C4_    50     1.54139   114.50640  -166.48505
   51    50 S   HC   _H6_    51     1.09576   110.47482  -166.85456
   52    50 S   HC   _H7_    52     1.09579   110.43689    73.75201
   53    50 S   HC   _H8_    53     1.09283   113.54331   -46.51612
   54    47 S   CT   _C13    54     1.53351   118.07678   -38.19199
   55    54 S   HC   _H13    55     1.09580   110.52463   169.59444
   56    54 S   HC   _H14    56     1.09196   113.73737    49.42707
   57    54 S   HC   _H15    57     1.09577   110.54304   -71.01422
   58    33 S   CT   _C12    46     1.55644   110.84918    76.34336
   59    58 S   HC   _H11    47     1.09740   109.01564  -126.13581
   60    58 S   HC   _H12    48     1.09661   112.10829    -9.71612
  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   9   5   4   3
  14   7   2   1   1  15  19   8   5   1   1  10   5   4  13  12
   5   8   3   2   1   4   2   1   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    58    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    58    59    60    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    48    49    58    59    60    47    41    42    43  
   38    39    48    58    59    60    41  
   36    37  
   37  
    0  
   39    40    44    45    46    48    58    59    60    47    50    54    41    42    43  
   40    44    45    46    48    49    58    47    50    51    52    53    54    55    56    57    41    42    43  
   44    45    46    48    47    50    54    41  
   42    43    44    47    58  
   43  
    0  
   45    46    48    49    58    59    60    47    50    54  
   46    48    49    58    47  
   48    49    58    47  
   50    51    52    53    54    55    56    57    48    49    58    59    60  
   49    58    59    60    50    51    52    53    54    55    56    57  
   58    59    60    50    54  
   51    52    53    54    55    56    57    58  
   52    53    54  
   53    54  
   54  
   55    56    57    58  
   56    57  
   57  
    0  
   59    60  
   60  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.117600   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660  -0.118800   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  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    58   268.000  1.529
   38    39   317.000  1.510
   38    41   465.000  1.376
   39    40   340.000  1.090
   39    44   268.000  1.529
   39    47   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   268.000  1.529
   48    49   340.000  1.090
   48    58   260.000  1.519
   48    47   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   47    50   260.000  1.519
   47    54   260.000  1.519
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   41    42   745.000  1.250
   41    43   745.000  1.250
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    58    75.00000  111.63000
   33    38    39    65.00000  117.92700
   33    38    41    70.00000  124.00000
   33    58    48    70.00000  112.98000
   33    58    59    37.50000  110.70000
   33    58    60    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    44    70.00000  112.02700
   38    39    47    70.00000  112.02700
   38    41    42    65.00000  137.10300
   38    41    43    65.00000  137.10300
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    48    63.00000   92.00000
   39    47    48    63.00000   92.00000
   39    47    50    65.00000  119.52000
   39    47    54    65.00000  119.52000
   44    39    40    37.50000  110.70000
   44    48    49    37.50000  110.70000
   44    48    58    65.00000  119.52000
   44    48    47    63.00000   92.00000
   46    44    45    33.00000  107.80000
   48    44    45    37.50000  110.70000
   48    44    46    37.50000  110.70000
   48    58    59    45.00000  111.22300
   48    58    60    45.00000  111.22300
   48    47    50    65.00000  119.52000
   48    47    54    65.00000  119.52000
   58    33    34    37.50000  110.70000
   58    33    38    70.00000  112.02700
   58    48    49    45.00000  112.72800
   60    58    59    33.00000  107.80000
   47    39    40    37.50000  110.70000
   47    39    44    63.00000   92.00000
   47    48    49    37.50000  110.70000
   47    48    58    65.00000  119.52000
   47    50    51    45.00000  111.22300
   47    50    52    45.00000  111.22300
   47    50    53    45.00000  111.22300
   47    54    55    45.00000  111.22300
   47    54    56    45.00000  111.22300
   47    54    57    45.00000  111.22300
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   54    47    50    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   41    38    39    70.00000  124.00000
   43    41    42    65.00000  121.00000
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    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    58    48   0.44750  1.0 1.0
   29    33    58    48  -0.17800 -1.0 2.0
   29    33    58    48   0.20200  1.0 3.0
   29    33    58    59   0.15000  1.0 3.0
   29    33    58    60   0.15000  1.0 3.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    44   0.46850  1.0 1.0
   33    38    39    44   0.08550 -1.0 2.0
   33    38    39    44   0.09800  1.0 3.0
   33    38    39    47   0.46850  1.0 1.0
   33    38    39    47   0.08550 -1.0 2.0
   33    38    39    47   0.09800  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    43   7.00000 -1.0 2.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    58    48   0.15000  1.0 3.0
   34    33    58    59   0.15000  1.0 3.0
   34    33    58    60   0.15000  1.0 3.0
   38    33    58    48   0.34400  1.0 1.0
   38    33    58    48   0.09450 -1.0 2.0
   38    33    58    48   0.11100  1.0 3.0
   38    33    58    59   0.15000  1.0 3.0
   38    33    58    60   0.15000  1.0 3.0
   38    39    44    45   0.15000  1.0 3.0
   38    39    44    46   0.15000  1.0 3.0
   38    39   -44    48   0.34400  1.0 1.0
   38    39   -44    48   0.09450 -1.0 2.0
   38    39   -44    48   0.11100  1.0 3.0
   38    39   -47    48   0.34400  1.0 1.0
   38    39   -47    48   0.09450 -1.0 2.0
   38    39   -47    48   0.11100  1.0 3.0
   38    39    47    50   0.34400  1.0 1.0
   38    39    47    50   0.09450 -1.0 2.0
   38    39    47    50   0.11100  1.0 3.0
   38    39    47    54   0.34400  1.0 1.0
   38    39    47    54   0.09450 -1.0 2.0
   38    39    47    54   0.11100  1.0 3.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    43   7.00000 -1.0 2.0
   39    44    48    49   0.15000  1.0 3.0
   39    44    48    58  -0.70950  1.0 1.0
   39    44    48    58   0.38400 -1.0 2.0
   39    44   -48    47   0.00000  1.0 1.0
   39    47    50    51   0.00000  1.0 1.0
   39    47    50    52   0.00000  1.0 1.0
   39    47    50    53   0.00000  1.0 1.0
   39    47    54    55   0.00000  1.0 1.0
   39    47    54    56   0.00000  1.0 1.0
   39    47    54    57   0.00000  1.0 1.0
   40    39    44    45   0.15000  1.0 3.0
   40    39    44    46   0.15000  1.0 3.0
   40    39    44    48   0.15000  1.0 3.0
   40    39   -47    48   0.15000  1.0 3.0
   40    39    47    50   0.15000  1.0 3.0
   40    39    47    54   0.15000  1.0 3.0
   44    39   -47    48   0.00000  1.0 1.0
   44    39    47    50  -0.70950  1.0 1.0
   44    39    47    50   0.38400 -1.0 2.0
   44    39    47    54  -0.70950  1.0 1.0
   44    39    47    54   0.38400 -1.0 2.0
   44    48   -58    33   0.04050  1.0 1.0
   44    48   -58    33   0.63700 -1.0 2.0
   44    48   -58    33   0.17650  1.0 3.0
   44    48    58    59   0.00000  1.0 1.0
   44    48    58    60   0.00000  1.0 1.0
   44    48   -47    39   0.00000  1.0 1.0
   44    48   -47    50  -0.70950  1.0 1.0
   44    48   -47    50   0.38400 -1.0 2.0
   44    48   -47    54  -0.70950  1.0 1.0
   44    48   -47    54   0.38400 -1.0 2.0
   45    44    48    49   0.15000  1.0 3.0
   45    44    48    58   0.15000  1.0 3.0
   45    44    48    47   0.15000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    44    48    58   0.15000  1.0 3.0
   46    44    48    47   0.15000  1.0 3.0
   48    47    50    51   0.00000  1.0 1.0
   48    47    50    52   0.00000  1.0 1.0
   48    47    50    53   0.00000  1.0 1.0
   48    47    54    55   0.00000  1.0 1.0
   48    47    54    56   0.00000  1.0 1.0
   48    47    54    57   0.00000  1.0 1.0
   49    48    58    33   0.15000  1.0 3.0
   49    48    58    59   0.15000  1.0 3.0
   49    48    58    60   0.15000  1.0 3.0
   49    48   -47    39   0.15000  1.0 3.0
   49    48    47    50   0.15000  1.0 3.0
   49    48    47    54   0.15000  1.0 3.0
   58    33   -38    39   0.46850  1.0 1.0
   58    33   -38    39   0.08550 -1.0 2.0
   58    33   -38    39   0.09800  1.0 3.0
   58    33    38    41   0.09850  1.0 1.0
   58    33    38    41   0.15250 -1.0 2.0
   58    33    38    41  -0.50650  1.0 3.0
   58    48   -47    39  -0.70950  1.0 1.0
   58    48   -47    39   0.38400 -1.0 2.0
   58    48    47    50   0.56750  1.0 1.0
   58    48    47    50  -0.07550 -1.0 2.0
   58    48    47    50   0.20000  1.0 3.0
   58    48    47    54   0.56750  1.0 1.0
   58    48    47    54  -0.07550 -1.0 2.0
   58    48    47    54   0.20000  1.0 3.0
   47    39   -44    45   0.15000  1.0 3.0
   47    39   -44    46   0.15000  1.0 3.0
   47    39   -44    48   0.00000  1.0 1.0
   47    48   -58    33   0.04050  1.0 1.0
   47    48   -58    33   0.63700 -1.0 2.0
   47    48   -58    33   0.17650  1.0 3.0
   47    48    58    59   0.00000  1.0 1.0
   47    48    58    60   0.00000  1.0 1.0
   50    47    54    55   0.15000  1.0 3.0
   50    47    54    56   0.15000  1.0 3.0
   50    47    54    57   0.15000  1.0 3.0
   54    47    50    51   0.15000  1.0 3.0
   54    47    50    52   0.15000  1.0 3.0
   54    47    50    53   0.15000  1.0 3.0
   41    38    39    40   0.00000  1.0 1.0
   41    38    39    44   0.09850  1.0 1.0
   41    38    39    44   0.15250 -1.0 2.0
   41    38    39    44  -0.50650  1.0 3.0
   41    38    39    47   0.09850  1.0 1.0
   41    38    39    47   0.15250 -1.0 2.0
   41    38    39    47  -0.50650  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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    41   1.10000 -1.0 2.0
   42    43    41    38   1.10000 -1.0 2.0
END
